In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 26th, 2009 | 32 | Yes |
Popular Name: 6-[(4-methoxybenzoyl)amino]-2-(4-methyl-1,4-diazepan-1-yl)quinoline-4-carboxylic 6-[(4-methoxybenzoyl)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) | 3.28 | 9.06 | -69.9 | 2 | 8 | 0 | 99 | 434.496 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.28 | 6.82 | -50.95 | 1 | 8 | -1 | 98 | 433.488 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 9.2 | -95.53 | 3 | 8 | 1 | 100 | 435.504 | 5 | ↓ |