In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 28 | Yes |
Popular Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylpiperazin-1-yl)methanone [3-(3,4-dimethylphenyl)-1-phenyl…
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) | 2.94 | 9.83 | -13.35 | 0 | 5 | 0 | 41 | 374.488 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 12.19 | -53.72 | 1 | 5 | 1 | 43 | 375.496 | 3 | ↓ |