In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (3,5-dimethyl-1H-pyrazol-4-yl)-(4-prop-2-ynylpiperazin-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) | -0.29 | 3.02 | -10.36 | 1 | 5 | 0 | 52 | 246.314 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.29 | 5.26 | -47.19 | 2 | 5 | 1 | 53 | 247.322 | 2 | ↓ |