In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 26th, 2008 | 25 | No |
Popular Name: (3aS,7aR)-2-[3-(piperidine-1-carbonyl)phenyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (3aS,7aR)-2-[3-(piperidine-1-car…
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) | 2.55 | 9.15 | -14.72 | 0 | 5 | 0 | 58 | 340.423 | 2 | ↓ |
Ref Reference (pH 7) | 2.55 | 9.18 | -16.58 | 0 | 5 | 0 | 58 | 340.423 | 2 | ↓ |