Type:
Small moleculeAlogP:
0.03Polar Surface Area:
103.96HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
Small moleculeAlogP:
0.67Polar Surface Area:
94.73HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
Small moleculeAlogP:
0.03Polar Surface Area:
103.96HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
Small moleculeAlogP:
0.67Polar Surface Area:
94.73HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.52DETAILS
ALA4162232Name:
N-{Imino-[4-(pyridin-2-yl)piperazin-1-yl]methyl}guanidine dihydrochlorideMol. Formula:
C11H19Cl2N7M.W.:
320.23Type:
Small moleculeAlogP:
-0.59Polar Surface Area:
107.62HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.45DETAILS-
Type:
Small moleculeAlogP:
1.04Polar Surface Area:
94.73HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA1962870
Name:
1-((5,5-diphenyltetrahydrofuran-2-yl)methyl)-4-(2-methoxyphenyl)piperazineMol. Formula:
C28H32N2O2M.W.:
428.58Type:
Small moleculeAlogP:
4.94Polar Surface Area:
24.94HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA1962769
Name:
N-((5,5-diphenyltetrahydrofuran-2-yl)methyl)-2-(2-methoxyphenoxy)ethanamineMol. Formula:
C26H29NO3M.W.:
403.52Type:
Small moleculeAlogP:
4.79Polar Surface Area:
39.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.52DETAILS
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