In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 30 | Yes |
Popular Name: 6-(4-methylpiperazin-1-yl)sulfonyl-3-(4-methylpiperidine-1-carbonyl)-1H-quinolin-4-one 6-(4-methylpiperazin-1-yl)sulfon…
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) | -0.07 | 4.44 | -29.86 | 1 | 8 | 0 | 94 | 432.546 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.23 | 3.02 | -55.26 | 0 | 8 | -1 | 97 | 431.538 | 3 | ↓ |