In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: N-(2-diethylaminoethyl)-2-(4-methylpiperazin-1-yl)pyridine-3-carboxamide N-(2-diethylaminoethyl)-2-(4-met…
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) | 0.96 | 8.44 | -81.06 | 3 | 6 | 2 | 54 | 321.469 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 6.08 | -43.83 | 2 | 6 | 1 | 53 | 320.461 | 7 | ↓ |