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ALA4878567 Name:
3'-(5-amino-2-chloro-4-fluoro-3-methylbenzamido)-4
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Mol. Formula:
C26H26ClFN4O3
M.W.:
496.97
Type:
Unknown
AlogP:
4.74
Polar Surface Area:
98.90
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4877455 Name:
5-amino-2-chloro-4-fluoro-N-(5-(3-(4-hydroxycycloh
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Mol. Formula:
C29H35ClFN5O3
M.W.:
556.08
Type:
Unknown
AlogP:
3.39
Polar Surface Area:
110.93
HBA:
6
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4869658 Name:
1-(3-(5-amino-2-chloro-4-fluoro-3-methylbenzamido)
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Mol. Formula:
C28H35ClFN9O2
M.W.:
584.10
Type:
Unknown
AlogP:
2.78
Polar Surface Area:
124.65
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4868755 Name:
3'-(5-amino-2-chloro-4-fluoro-3-methylbenzamido)-N
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Mol. Formula:
C28H31ClFN5O2
M.W.:
524.04
Type:
Unknown
AlogP:
4.74
Polar Surface Area:
81.91
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4868706 Name:
Methyl (3-(5-amino-2-chloro-4-fluoro-3-methylbenza
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Mol. Formula:
C23H25ClFN7O3
M.W.:
501.95
Type:
Unknown
AlogP:
2.74
Polar Surface Area:
118.61
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4868412 Name:
N1-(3-(3-(5-amino-2-chloro-4-fluoro-3-methylbenzam
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Mol. Formula:
C32H34ClFN6O3
M.W.:
605.11
Type:
Unknown
AlogP:
3.86
Polar Surface Area:
111.01
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.29
DETAILS
CLOSE
ALA4866458 Name:
1-(3-(5-amino-2-chloro-4-fluoro-3-methylbenzamido)
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Mol. Formula:
C22H23ClFN7O3
M.W.:
487.92
Type:
Unknown
AlogP:
2.65
Polar Surface Area:
129.61
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4864032 Name:
5-amino-2-chloro-4-fluoro-3-methyl-N-(2-(4-methylp
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Mol. Formula:
C34H36ClFN6O4
M.W.:
647.15
Type:
Unknown
AlogP:
3.63
Polar Surface Area:
120.24
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4863061 Name:
1-(3-(5-amino-2-chloro-4-fluoro-3-methylbenzamido)
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Mol. Formula:
C27H32ClFN8O3
M.W.:
571.06
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
130.64
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA4857312 Name:
N-(3-(3-(5-amino-2-chloro-4-fluoro-3-methylbenzami
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Mol. Formula:
C28H33ClFN5O3
M.W.:
542.06
Type:
Unknown
AlogP:
3.27
Polar Surface Area:
99.93
HBA:
6
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA1082290 Name:
(7S,24S,27S,30S,33S,36S,39S,42S)-36-((1H-imidazol-
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Mol. Formula:
C91H136N24O24
M.W.:
1950.23
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1082289 Name:
(7S,24S,27S,30S,33S,36S,39S,42S)-36-((1H-imidazol-
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Mol. Formula:
C90H134N24O23
M.W.:
1920.21
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1082288 Name:
(7S,24S,27S,30S,33S,36S,39S,42S)-36-((1H-imidazol-
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Mol. Formula:
C95H142N26O26
M.W.:
2064.34
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1082287 Name:
(7S,19S,22S,25S,28S,31S,34S,37S)-31-((1H-imidazol-
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Mol. Formula:
C89H129N27O27
M.W.:
2009.17
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1082286 Name:
H2N-ARTK(Me3)QTARKS-NH2
Mol. Formula:
C49H94N20O14
M.W.:
1187.42
Type:
Protein
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1082285 Name:
H2N-ARTK(Me2)QTARKS-NH2
Mol. Formula:
C48H92N20O14
M.W.:
1173.39
Type:
Protein
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1082284 Name:
H2N-ARTK(Me)QTARKS-NH2
Mol. Formula:
C47H90N20O14
M.W.:
1159.36
Type:
Protein
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA1085865 Name:
Ac-ART-NH2
Mol. Formula:
C15H29N7O5
M.W.:
387.44
Type:
Protein
AlogP:
-3.39
Polar Surface Area:
212.52
HBA:
6
HBD:
8
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE
ALA1085864 Name:
H2N-ART-NH2
Mol. Formula:
C13H27N7O4
M.W.:
345.40
Type:
Protein
AlogP:
-3.57
Polar Surface Area:
209.44
HBA:
6
HBD:
8
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA1082282 Name:
Ac-ARTKQTARKS-NH2
Mol. Formula:
C48H90N20O15
M.W.:
1187.37
Type:
Protein
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
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