In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 36 | Yes |
Popular Name: 2-[4-[1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carbonyl]piperazin-1-yl]-N,N-diethyl-acetamide 2-[4-[1-benzyl-3-(4-methoxypheny…
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) | 2.60 | 13.22 | -50.57 | 1 | 8 | 1 | 72 | 490.628 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 11.02 | -16.61 | 0 | 8 | 0 | 71 | 489.62 | 9 | ↓ |