In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 27th, 2011 | 26 | No |
Popular Name: 1-[(4aR,9aS)-1,2,3,4,4a,9a-hexahydrocarbazol-9-yl]-2-(2H-benzimidazol-2-ylsulfanyl)ethanone 1-[(4aR,9aS)-1,2,3,4,4a,9a-hexah…
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) | 4.51 | 9.53 | -111.87 | 2 | 4 | 2 | 48 | 365.502 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.