In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 25 | Yes |
Popular Name: (2S,4aS,8aR)-1-benzyl-8a-methyl-2-phenyl-3,4a,5,6,7,8-hexahydro-2H-quinolin-4-one (2S,4aS,8aR)-1-benzyl-8a-methyl-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.84 | 10.17 | -5.55 | 0 | 2 | 0 | 20 | 333.475 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.84 | 11.88 | -40.14 | 1 | 2 | 1 | 22 | 334.483 | 3 | ↓ |