In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 29 | Yes |
Popular Name: 2-[[1-(m-tolylmethyl)-4-piperidyl]methylamino]quinoline-4-carboxylic 2-[[1-(m-tolylmethyl)-4-piperidy…
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) | 4.57 | 12.7 | -96.41 | 3 | 5 | 1 | 71 | 390.507 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.57 | 12.27 | -75.43 | 2 | 5 | 0 | 69 | 389.499 | 6 | ↓ |