Type:
Small moleculeAlogP:
5.78Polar Surface Area:
50.08HBA:
3HBD:
3#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.40DETAILS
Type:
Small moleculeAlogP:
5.00Polar Surface Area:
50.08HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.51DETAILS
ALA3260560Name:
N1-(4-Aminobutyl)-N4-cyclopentadecylbutane-1,4-diamine trihydrochlorideMol. Formula:
C23H50ClN3M.W.:
404.13Type:
Small moleculeAlogP:
5.53Polar Surface Area:
50.08HBA:
3HBD:
3#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.45DETAILS
ALA3260559Name:
N1-(3-Aminopropyl)-N3-cyclopentadecylpropane-1,3-diamine trihydrochlorideMol. Formula:
C21H46ClN3M.W.:
376.07Type:
Small moleculeAlogP:
4.75Polar Surface Area:
50.08HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.56DETAILS
ALA3260558Name:
N1-(4-(azacyclopentadecan-1-yl)butyl)butane-1,4-diamine trihydrochlorideMol. Formula:
C22H48ClN3M.W.:
390.10Type:
Small moleculeAlogP:
5.09Polar Surface Area:
41.29HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.57DETAILS-
Type:
Small moleculeAlogP:
4.31Polar Surface Area:
41.29HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA560754
Name:
N1-(7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)butane-1,4-diamineMol. Formula:
C10H13N5O3M.W.:
251.25Type:
Small moleculeAlogP:
1.28Polar Surface Area:
120.11HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS
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