In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (3,5-dimethyl-1H-pyrazol-4-yl)-(4-isobutylpiperazin-1-yl)methanone (3,5-dimethyl-1H-pyrazol-4-yl)-(…
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) | 0.67 | 6.14 | -45.45 | 2 | 5 | 1 | 53 | 265.381 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 4.22 | -8.51 | 1 | 5 | 0 | 52 | 264.373 | 3 | ↓ |