In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2008 | 26 | No |
Popular Name: (4-amino-3-nitro-phenyl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone (4-amino-3-nitro-phenyl)-[4-(2,3…
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) | 2.66 | 9.27 | -13.83 | 2 | 7 | 0 | 95 | 354.41 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 9.12 | -50.63 | 3 | 7 | 1 | 97 | 355.418 | 3 | ↓ |