In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2009 | 31 | Yes |
Popular Name: (3S)-1-(4-chlorobenzoyl)-N-[(2-morpholino-3-pyridyl)methyl]piperidine-3-carboxamide (3S)-1-(4-chlorobenzoyl)-N-[(2-m…
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) | 1.86 | 8.96 | -40.17 | 2 | 7 | 1 | 76 | 443.955 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.86 | 8.49 | -12.23 | 1 | 7 | 0 | 75 | 442.947 | 5 | ↓ |