In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 23 | Yes |
Popular Name: 1-butylsulfonyl-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]piperazine 1-butylsulfonyl-4-[(1-ethyl-3,5-…
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) | 1.64 | 4.39 | -13.78 | 0 | 6 | 0 | 58 | 342.509 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 6.6 | -54.53 | 1 | 6 | 1 | 60 | 343.517 | 7 | ↓ |