In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2009 | 33 | Yes |
Popular Name: 2-(4-acetamidophenyl)-6-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]quinoline-4-carboxamide 2-(4-acetamidophenyl)-6-methyl-N…
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) | 2.82 | 7.96 | -60.36 | 3 | 7 | 1 | 79 | 446.575 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 7.83 | -66.66 | 3 | 7 | 1 | 79 | 446.575 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 5.49 | -24.25 | 2 | 7 | 0 | 78 | 445.567 | 6 | ↓ |