Type:
Small moleculeAlogP:
-0.50Polar Surface Area:
243.32HBA:
10HBD:
9#RO5 Violations:
2#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.10DETAILS
Type:
Small moleculeAlogP:
1.27Polar Surface Area:
185.12HBA:
8HBD:
7#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.17DETAILS
Type:
Small moleculeAlogP:
2.13Polar Surface Area:
85.77HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.71DETAILS
Type:
Small moleculeAlogP:
3.86Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.62DETAILS
ALA212743Name:
1-[3-(3-biphenyl)-(1,2,4-triazol-4-yl)]-3-phenolMol. Formula:
C20H15N3OM.W.:
313.36Type:
Small moleculeAlogP:
4.31Polar Surface Area:
50.94HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.61DETAILS-
Type:
Small moleculeAlogP:
4.37Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.59DETAILS -
Type:
Small moleculeAlogP:
4.37Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.59DETAILS -
Type:
Small moleculeAlogP:
4.00Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
Small moleculeAlogP:
3.79Polar Surface Area:
50.94HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
Small moleculeAlogP:
4.04Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA208801
Name:
1-[3-(4-biphenyl)-(1,2,4-triazol-4-yl)]-3-phenolMol. Formula:
C20H15N3OM.W.:
313.36Type:
Small moleculeAlogP:
4.31Polar Surface Area:
50.94HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
Small moleculeAlogP:
4.00Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
Small moleculeAlogP:
4.00Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
Small moleculeAlogP:
4.00Polar Surface Area:
54.18HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.79DETAILS
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