In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 30 | Yes |
Popular Name: 4-[(2S)-5-chloro-2-(2-pyridyl)-2H-indol-3-yl]-N-(3-imidazol-1-ylpropyl)butanamide 4-[(2S)-5-chloro-2-(2-pyridyl)-2…
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) | 3.30 | 12.56 | -44.88 | 3 | 6 | 1 | 77 | 422.94 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.30 | 12.05 | -18.09 | 2 | 6 | 0 | 76 | 421.932 | 9 | ↓ |