In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 28th, 2006 | 29 | No |
Popular Name: (4-cyclopropylamino-3-nitro-phenyl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]-methanone (4-cyclopropylamino-3-nitro-phen…
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) | 3.40 | 11.87 | -13.85 | 1 | 7 | 0 | 81 | 394.475 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 11.73 | -51.63 | 2 | 7 | 1 | 83 | 395.483 | 5 | ↓ |