Type:
Small moleculeAlogP:
1.62Polar Surface Area:
144.40HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.21DETAILS
Type:
Small moleculeAlogP:
3.00Polar Surface Area:
52.19HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.54DETAILS
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA3542374Name:
finasteride-omega-oic acidCas Number:
116285-37-1Mol. Formula:
C23H34N2O4M.W.:
402.54Type:
Small moleculeAlogP:
2.88Polar Surface Area:
95.50HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.68DETAILS
Type:
Small moleculeAlogP:
4.53Polar Surface Area:
109.25HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.44DETAILS-
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
0.34Polar Surface Area:
334.41HBA:
12HBD:
10#RO5 Violations:
3#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.05DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
3.52Polar Surface Area:
59.06HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
3.02Polar Surface Area:
232.29HBA:
14HBD:
5#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.11DETAILS -
Type:
Small moleculeAlogP:
-1.49Polar Surface Area:
195.60HBA:
12HBD:
7#RO5 Violations:
3#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
4.18Polar Surface Area:
102.20HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
Small moleculeAlogP:
11.58Polar Surface Area:
88.13HBA:
7HBD:
---#RO5 Violations:
2#Rotatable Bonds:
35Passes Ro3:
NQED Weighted:
0.04DETAILS -
Type:
Small moleculeAlogP:
8.10Polar Surface Area:
64.63HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
24Passes Ro3:
NQED Weighted:
0.12DETAILS -
Type:
Small moleculeAlogP:
7.32Polar Surface Area:
64.63HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
22Passes Ro3:
NQED Weighted:
0.15DETAILS -
Type:
Small moleculeAlogP:
11.19Polar Surface Area:
88.13HBA:
7HBD:
---#RO5 Violations:
2#Rotatable Bonds:
34Passes Ro3:
NQED Weighted:
0.04DETAILS -
Type:
Small moleculeAlogP:
10.33Polar Surface Area:
93.73HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
34Passes Ro3:
NQED Weighted:
0.05DETAILS -
Type:
Small moleculeAlogP:
8.88Polar Surface Area:
64.63HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
26Passes Ro3:
NQED Weighted:
0.10DETAILS
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