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ALA4547831 Name:
4-((5-methyl-1H-benzo[d]imidazol-2-yl)methylamino)
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Mol. Formula:
C17H19N5O2
M.W.:
325.37
Type:
Unknown
AlogP:
2.77
Polar Surface Area:
90.58
HBA:
3
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4547455 Name:
rac-4-((1-hydroxy-5-methoxy-1,3-dihydrobenzo[c][1,
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Mol. Formula:
C22H23BClN3O4
M.W.:
439.71
Type:
Unknown
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4550494 Name:
NA
Mol. Formula:
C71H93N19O21S2
M.W.:
1612.77
Type:
Unknown
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA4549755 Name:
(5S,E)-tert-butyl 5-benzyl-3-(1-hydroxy-3-methylbu
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Mol. Formula:
C21H27NO5
M.W.:
373.45
Type:
Unknown
AlogP:
3.80
Polar Surface Area:
83.91
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA4549483 Name:
4-((5-methoxy-1H-benzo[d]imidazol-2-yl)methylamino
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Mol. Formula:
C16H17N5O
M.W.:
295.35
Type:
Unknown
AlogP:
2.47
Polar Surface Area:
99.81
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4524559 Name:
2-(2-carbamimidoyl-5-((4-phenyl-1H-imidazol-2-yl)m
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Mol. Formula:
C20H22N6O4
M.W.:
410.43
Type:
Unknown
AlogP:
1.84
Polar Surface Area:
142.90
HBA:
5
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA5209454 Name:
Mol. Formula:
C96H137N29O27S4
M.W.:
2257.60
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5205331 Name:
(3S,6S,9S,12S,15R,23R,26S)-15-[(2-aminoacetyl)amin
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Mol. Formula:
C40H60N12O13S2
M.W.:
981.12
Type:
---
AlogP:
-5.16
Polar Surface Area:
420.75
HBA:
16
HBD:
14
#RO5 Violations:
3
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.05
DETAILS
CLOSE
ALA5203652 Name:
5-[2-[2-[2-[[(1S)-1-[[(1S)-2-[[(1S)-1-[[(1S)-1-[[(
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Mol. Formula:
C143H199N27O45S2
M.W.:
3080.44
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5203584 Name:
(5R,8S,11S,14S,17S,20R)-5-[(2-aminoacetyl)amino]-1
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Mol. Formula:
C41H57N13O10S2
M.W.:
956.12
Type:
---
AlogP:
-2.85
Polar Surface Area:
391.82
HBA:
14
HBD:
14
#RO5 Violations:
3
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.05
DETAILS
CLOSE
ALA5203034 Name:
Mol. Formula:
C90H129N25O26S4
M.W.:
2105.44
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5199103 Name:
Mol. Formula:
C53H74N16O16S2
M.W.:
1255.40
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5198215 Name:
(3S,6S,9S,12S,15S,18R,26R,29S,32S,35S)-18-[(2-amin
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Mol. Formula:
C55H82N16O18S2
M.W.:
1319.49
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5196523 Name:
(2S)-1-[(3R,11R,14S,17S,20S,23S)-3-[[(3S,6S,9S,12S
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Mol. Formula:
C91H139N27O28S5
M.W.:
2219.61
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5194536 Name:
(3S,6S,9S,12S,15R,23R,26S)-15-[(2-aminoacetyl)amin
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Mol. Formula:
C42H60N12O13S2
M.W.:
1005.15
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5194019 Name:
(5R,8S,11S,14S,17S,20R)-5-[(2-aminoacetyl)amino]-1
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Mol. Formula:
C35H56N12O10S2
M.W.:
869.04
Type:
---
AlogP:
-3.92
Polar Surface Area:
376.03
HBA:
14
HBD:
13
#RO5 Violations:
3
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.05
DETAILS
CLOSE
ALA5192991 Name:
Mol. Formula:
C50H69N15O14S2
M.W.:
1168.33
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5192120 Name:
Mol. Formula:
C85H129N27O26S4
M.W.:
2073.40
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5185690 Name:
(3S,6S,9S,12S,15S,18R,26R,29S)-18-[(2-aminoacetyl)
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Mol. Formula:
C46H66N14O15S2
M.W.:
1119.25
Type:
---
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA5181364 Name:
(5R,8S,11S,14S,17S,20R)-5-[(2-aminoacetyl)amino]-1
Show More⌵
Mol. Formula:
C41H56N12O11S2
M.W.:
957.11
Type:
---
AlogP:
-2.25
Polar Surface Area:
386.03
HBA:
14
HBD:
14
#RO5 Violations:
3
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.05
DETAILS
CLOSE
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