In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 25 | Yes |
Popular Name: 2-(1,4-diazepan-1-yl)-N-[(1S)-2-hydroxy-1-phenyl-ethyl]pyridine-3-carboxamide 2-(1,4-diazepan-1-yl)-N-[(1S)-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) | 0.80 | 5.44 | -39.14 | 4 | 6 | 1 | 82 | 341.435 | 5 | ↓ |