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ALA4762271 Name:
(S)-N-(2-amino-2-oxoethyl)-4-methyl-2-((S)-pyrroli
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Mol. Formula:
C13H26N4O2
M.W.:
270.38
Type:
Unknown
AlogP:
-0.66
Polar Surface Area:
96.25
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA2372919 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Cas Number:
3481-36-5
Mol. Formula:
C13H24N4O3
M.W.:
284.36
Type:
Protein
AlogP:
-1.13
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA2372918 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C11H20N4O3
M.W.:
256.31
Type:
Protein
AlogP:
-1.77
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA2372917 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Cas Number:
114390-34-0
Mol. Formula:
C16H22N4O3
M.W.:
318.38
Type:
Protein
AlogP:
-0.93
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA2372916 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C12H22N4O3
M.W.:
270.33
Type:
Protein
AlogP:
-1.38
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA2372915 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C13H24N4O3
M.W.:
284.36
Type:
Protein
AlogP:
-0.99
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA2372914 Name:
Pyrrolidine-2-carboxylic acid [(carbamoylmethyl-ca
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Mol. Formula:
C15H20N4O3
M.W.:
304.35
Type:
Protein
AlogP:
-0.80
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA2372912 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C16H21N5O5
M.W.:
363.37
Type:
Protein
AlogP:
-1.02
Polar Surface Area:
156.46
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA2372908 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C17H24N4O4
M.W.:
348.40
Type:
Protein
AlogP:
-0.92
Polar Surface Area:
122.55
HBA:
5
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA2370032 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C17H24N4O3
M.W.:
332.40
Type:
Protein
AlogP:
-0.54
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA2370030 Name:
Pyrrolidine-2-carboxylic acid [1-(carbamoylmethyl-
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Mol. Formula:
C17H24N4O3
M.W.:
332.40
Type:
Protein
AlogP:
-0.54
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA2112404 Name:
4-Benzyl-pyrrolidine-3-carboxylic acid [1-(carbamo
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Mol. Formula:
C20H30N4O3
M.W.:
374.49
Type:
Small molecule
AlogP:
0.20
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA2111600 Name:
4-Benzyl-pyrrolidine-3-carboxylic acid [1-(carbamo
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Mol. Formula:
C20H30N4O3
M.W.:
374.49
Type:
Small molecule
AlogP:
0.20
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA2111599 Name:
4-Benzyl-pyrrolidine-3-carboxylic acid [1-(carbamo
Show More⌵
Mol. Formula:
C20H30N4O3
M.W.:
374.49
Type:
Small molecule
AlogP:
0.20
Polar Surface Area:
113.32
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA607228 Name:
(3S,7aR)-6-((2R,8aS)-1,4-Dioxo-hexahydro-pyrrolo[1
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Mol. Formula:
C14H18N4O4S
M.W.:
338.39
Type:
Small molecule
AlogP:
-1.65
Polar Surface Area:
104.02
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA555967 Name:
3(R)-[(4(S)-(4-azido-2-hydroxybenzoyl)amino-2(S)-p
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Mol. Formula:
C18H23ClN8O5
M.W.:
466.89
Type:
Small molecule
AlogP:
-1.00
Polar Surface Area:
202.62
HBA:
7
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA541131 Name:
N-(N-(4-azidobenzoyl)aminoethyl)-3(R)-[(2(S)-pyrro
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Mol. Formula:
C20H27ClN8O4
M.W.:
478.94
Type:
Small molecule
AlogP:
-0.06
Polar Surface Area:
168.40
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA540878 Name:
N-(N-(4-azido-2-hydroxy-5-iodobenzoyl)aminoethyl)-
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Mol. Formula:
C20H26ClIN8O5
M.W.:
620.84
Type:
Small molecule
AlogP:
0.25
Polar Surface Area:
188.63
HBA:
7
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA541634 Name:
3(R)-[(4(R)-(4-azidobenzoyl)amino-2(S)-pyrrolidiny
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Mol. Formula:
C18H23ClN8O4
M.W.:
450.89
Type:
Small molecule
AlogP:
-0.71
Polar Surface Area:
182.39
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
ALA557641 Name:
4-Hydroxy-7-{2-[2-(3-phenethyloxy-propane-1-sulfon
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Cas Number:
154189-24-9
Mol. Formula:
C22H29ClN2O5S2
M.W.:
501.07
Type:
Small molecule
AlogP:
2.90
Polar Surface Area:
108.75
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
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