In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2009 | 30 | Yes |
Popular Name: 6-[(4-chlorobenzoyl)amino]-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic 6-[(4-chlorobenzoyl)amino]-2-(4-…
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) | 3.63 | 9.26 | -69.85 | 2 | 7 | 0 | 90 | 424.888 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 9.51 | -99.31 | 3 | 7 | 1 | 91 | 425.896 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 6.79 | -49.14 | 1 | 7 | -1 | 89 | 423.88 | 4 | ↓ |