In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 27 | No |
Popular Name: 3-[N-(2,6-dichloro-4-nitro-phenyl)-C-methyl-carbonimidoyl]-4-hydroxy-1-methyl-quinolin-2-one 3-[N-(2,6-dichloro-4-nitro-pheny…
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) | 3.92 | 8.97 | -39.33 | 0 | 7 | -1 | 103 | 405.217 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 8.3 | -107.62 | 0 | 7 | -2 | 105 | 404.209 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 9.36 | -16.91 | 1 | 7 | 0 | 97 | 406.225 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.