In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 19 | Yes |
Popular Name: 2-(1H-benzimidazol-2-ylsulfanyl)-5-chloro-benzonitrile 2-(1H-benzimidazol-2-ylsulfanyl)…
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) | 4.24 | 8.3 | -10.4 | 1 | 3 | 0 | 52 | 285.759 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | 8.61 | -30.88 | 2 | 3 | 1 | 54 | 286.767 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.