In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2009 | 32 | Yes |
Popular Name: 6-[[2-(3-methylphenoxy)acetyl]amino]-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic 6-[[2-(3-methylphenoxy)acetyl]am…
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) | 3.34 | 11.99 | -71.92 | 2 | 8 | 0 | 99 | 434.496 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 9.63 | -51.24 | 1 | 8 | -1 | 98 | 433.488 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.34 | 12.29 | -93.23 | 3 | 8 | 1 | 100 | 435.504 | 6 | ↓ |