In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 24 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-(4-chloro-2-ethyl-5-methyl-pyrazol-3-yl)methanone (4-benzylpiperazin-1-yl)-(4-chlo…
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) | 2.56 | 7.47 | -8.77 | 0 | 5 | 0 | 41 | 346.862 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 9.69 | -47.94 | 1 | 5 | 1 | 43 | 347.87 | 4 | ↓ |