Type:
---AlogP:
2.37Polar Surface Area:
81.20HBA:
7HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.72DETAILS
Type:
Small moleculeAlogP:
1.49Polar Surface Area:
95.86HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILS
ALA4080116Name:
3,4-dihydro[1,4]oxazino[4,3-b][1,2]benzoxazol-1(10bH)-oneMol. Formula:
C10H9NO3M.W.:
191.19Type:
Small moleculeAlogP:
0.89Polar Surface Area:
38.77HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.57DETAILS
2-Hydroxypropane-1,2,3-tricarboxylic acid;piperazine;hydrateName:
PIPERAZINE CITRATEMol. Formula:
C24H48N6O15M.W.:
660.67Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
4.71Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.43DETAILS-
Type:
Small moleculeAlogP:
-0.41Polar Surface Area:
127.92HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
0.94Polar Surface Area:
111.18HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
3.31Polar Surface Area:
94.44HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.59DETAILS -
Type:
Small moleculeAlogP:
4.34Polar Surface Area:
94.44HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
Small moleculeAlogP:
2.28Polar Surface Area:
94.44HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.69DETAILS
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