In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 25 | Yes |
Popular Name: (3S)-N-isopropyl-1-[5-(3-pyridyl)-1H-pyrazole-3-carbonyl]piperidine-3-carboxamide (3S)-N-isopropyl-1-[5-(3-pyridyl…
None
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) | 1.15 | 4.98 | -13.33 | 2 | 7 | 0 | 91 | 341.415 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.15 | 4.84 | -12.6 | 2 | 7 | 0 | 91 | 341.415 | 4 | ↓ |