In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 27 | Yes |
Popular Name: 1-(1,3-benzodioxole-5-carbonyl)-N-(3-pyridylmethyl)piperidine-4-carboxamide 1-(1,3-benzodioxole-5-carbonyl)-…
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) | 0.84 | 5.33 | -18.29 | 1 | 7 | 0 | 81 | 367.405 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.84 | 5.8 | -50.79 | 2 | 7 | 1 | 82 | 368.413 | 4 | ↓ |