Type:
---AlogP:
1.59Polar Surface Area:
124.76HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.72DETAILS
Type:
---AlogP:
0.59Polar Surface Area:
124.76HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.71DETAILS
Type:
---AlogP:
0.01Polar Surface Area:
123.27HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.76DETAILS
Type:
---AlogP:
1.59Polar Surface Area:
124.76HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.72DETAILS
Type:
---AlogP:
0.96Polar Surface Area:
99.66HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.83DETAILS-
Type:
---AlogP:
3.19Polar Surface Area:
134.77HBA:
7HBD:
6#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
---AlogP:
3.14Polar Surface Area:
199.69HBA:
10HBD:
6#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.08DETAILS -
Type:
---AlogP:
2.80Polar Surface Area:
137.66HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA5204682
Name:
5-chloro-2-[(1R)-1-(6-methoxy-2-naphthyl)ethyl]-1H-benzimidazoleMol. Formula:
C20H17ClN2OM.W.:
336.82Type:
---AlogP:
5.53Polar Surface Area:
37.91HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA5199980
Name:
N-[(3-chlorophenyl)carbamothioyl]tetradecanamideMol. Formula:
C21H33ClN2OSM.W.:
397.03Type:
---AlogP:
6.85Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
13Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
---AlogP:
3.58Polar Surface Area:
114.12HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.31DETAILS - ALA5193802
Name:
1-[(E)-1-(benzofuran-2-yl)ethylideneamino]-3-(3-nitrophenyl)thioureaMol. Formula:
C17H14N4O3SM.W.:
354.39Type:
---AlogP:
4.05Polar Surface Area:
92.70HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
---AlogP:
2.67Polar Surface Area:
71.31HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
---AlogP:
8.39Polar Surface Area:
24.06HBA:
2HBD:
2#RO5 Violations:
2#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
---AlogP:
0.76Polar Surface Area:
288.66HBA:
17HBD:
9#RO5 Violations:
3#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.06DETAILS -
Type:
---AlogP:
1.93Polar Surface Area:
91.67HBA:
7HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA5183641
Name:
4-hydroxy-3-(3,4,5-trimethoxybenzoyl)chromen-2-oneMol. Formula:
C19H16O7M.W.:
356.33Type:
---AlogP:
2.76Polar Surface Area:
95.20HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
---AlogP:
2.96Polar Surface Area:
97.05HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA5182165
Name:
4-amino-3-(4-bromophenyl)-1H-1,2,4-triazole-5-thioneMol. Formula:
C8H7BrN4SM.W.:
271.14Type:
---AlogP:
2.08Polar Surface Area:
59.63HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
---AlogP:
1.35Polar Surface Area:
142.70HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.46DETAILS
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