| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 25 | No |
Popular Name: 4-hydroxy-1-methyl-3-[C-methyl-N-(3-nitrophenyl)carbonimidoyl]quinolin-2-one 4-hydroxy-1-methyl-3-[C-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) | 2.69 | 7.58 | -50.15 | 0 | 7 | -1 | 103 | 336.327 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 7.84 | -121.04 | 0 | 7 | -2 | 105 | 335.319 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 7.94 | -25.43 | 1 | 7 | 0 | 97 | 337.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
