In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 21 | Yes |
Popular Name: (1S,2S)-2-(5,6-dimethylbenzimidazol-1-yl)-1-phenyl-propan-1-amine (1S,2S)-2-(5,6-dimethylbenzimida…
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) | 1.78 | 9.59 | -50.74 | 3 | 3 | 1 | 45 | 280.395 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 9.32 | -6.95 | 2 | 3 | 0 | 44 | 279.387 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 10.03 | -114.74 | 4 | 3 | 2 | 47 | 281.403 | 3 | ↓ |