In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 24 | Yes |
Popular Name: (3S)-N-ethyl-1-[5-(4-pyridyl)-1H-pyrazole-3-carbonyl]piperidine-3-carboxamide (3S)-N-ethyl-1-[5-(4-pyridyl)-1H…
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) | 0.64 | 4.19 | -12.76 | 2 | 7 | 0 | 91 | 327.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 4.05 | -12.75 | 2 | 7 | 0 | 91 | 327.388 | 4 | ↓ |