In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 15 | No |
Popular Name: [3-(4-fluorophenyl)-1-methyl-pyrazol-4-yl]methanethiol [3-(4-fluorophenyl)-1-methyl-pyr…
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) | 2.44 | 6.58 | -7.18 | 0 | 2 | 0 | 18 | 222.288 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.44 | 7.06 | -44.7 | 0 | 2 | -1 | 18 | 221.28 | 2 | ↓ |