In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 26 | Yes |
Popular Name: 1-[(3-chlorophenyl)methyl]-4-[1-(difluoromethyl)-5-methyl-pyrazol-4-yl]sulfonyl-piperazine 1-[(3-chlorophenyl)methyl]-4-[1-…
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) | 2.35 | 4.28 | -12.46 | 0 | 6 | 0 | 58 | 404.87 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 6.51 | -56.2 | 1 | 6 | 1 | 60 | 405.878 | 5 | ↓ |