Compounds

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ALA4544421
Name:
O-4-(naphthalen-1-ylcarbamoyl)phenyl diethylcarbamothioate
Mol. Formula:
C22H22N2O2S
M.W.:
378.50
6 activity values
3 unique targets
Type:
Unknown
AlogP:
5.10
Polar Surface Area:
41.57
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4456824
Name:
9-iodophenanthrene-3-carboxylic acid
Mol. Formula:
C15H9IO2
M.W.:
348.14
12 activity values
8 unique targets
Type:
Unknown
AlogP:
4.30
Polar Surface Area:
37.30
HBA:
1
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4435232
Name:
4-cyclohexyl-N-(5-methyl-7-oxo-2-propyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pShow More⌵
Mol. Formula:
C21H27N5O3S
M.W.:
429.55

Type:
Unknown
AlogP:
3.53
Polar Surface Area:
109.22
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
pregnenolone sulphate
Name:
(3S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13Show More⌵
Mol. Formula:
C21H32O5S
M.W.:
396.55
12 activity values
6 unique targets
Type:
Small molecule
AlogP:
4.34
Polar Surface Area:
80.67
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE