In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 25 | No |
Popular Name: (3R)-3-acetyl-N-(3-cyanophenyl)-2-phenyl-3,4-dihydropyrazole-5-carboxamide (3R)-3-acetyl-N-(3-cyanophenyl)-…
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) | 2.15 | 8.08 | -13.97 | 1 | 6 | 0 | 86 | 332.363 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 6.18 | -48.89 | 0 | 6 | -1 | 92 | 331.355 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.