In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 20 | Yes |
Popular Name: [1-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]-4-piperidyl]methanamine [1-[(1R)-1-(1-methylbenzimidazol…
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) | 1.54 | 6.76 | -105 | 4 | 4 | 2 | 50 | 274.412 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 5.36 | -80.08 | 4 | 4 | 2 | 50 | 274.412 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 4.53 | -51.05 | 3 | 4 | 1 | 49 | 273.404 | 3 | ↓ |