Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILSType:
Small moleculeAlogP:
-0.16Polar Surface Area:
104.44HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.42DETAILS- ALA1254362
Name:
2-amino-3-(5-oxo-5H-benzo[a]phenoxazin-10-yl)propanoic acidMol. Formula:
C19H14N2O4M.W.:
334.33Type:
Small moleculeAlogP:
2.40Polar Surface Area:
106.42HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA1254361
Name:
6,6'-di(naphthalen-2-yl)-4,4'-bipyrimidine-2,2'-diamineMol. Formula:
C28H20N6M.W.:
440.51Type:
Small moleculeAlogP:
5.74Polar Surface Area:
103.60HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.36DETAILS Type:
Small moleculeAlogP:
1.30Polar Surface Area:
99.34HBA:
2HBD:
4#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.58DETAILSType:
Small moleculeAlogP:
0.43Polar Surface Area:
83.55HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.51DETAILS- ALA1253342
Name:
8-phenyl-1-thia-4,8-diazaspiro[4.5]decane-3-carboxylic acidMol. Formula:
C14H18N2O2SM.W.:
278.38Type:
Small moleculeAlogP:
1.77Polar Surface Area:
52.57HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS