In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 21 | Yes |
Popular Name: [4-(aminomethyl)-1-piperidyl]-(2-hydroxy-4-quinolyl)methanone [4-(aminomethyl)-1-piperidyl]-(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) | -0.06 | 3.58 | -56.03 | 4 | 5 | 1 | 81 | 286.355 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 1.41 | -84.59 | 3 | 5 | 0 | 84 | 285.347 | 2 | ↓ |