In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 1-[(2S)-2-(1-prop-2-ynylbenzimidazol-2-yl)pyrrolidin-1-yl]propan-1-one 1-[(2S)-2-(1-prop-2-ynylbenzimid…
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) | 2.35 | 8.87 | -15.82 | 0 | 4 | 0 | 38 | 281.359 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 9.36 | -28.58 | 1 | 4 | 1 | 39 | 282.367 | 3 | ↓ |