In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2004 | 26 | Yes |
Popular Name: (2R)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-(phenylthio)propionamide (2R)-N-(3-keto-1,5-dimethyl-2-ph…
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) | 2.93 | 9.63 | -28.64 | 1 | 5 | 0 | 56 | 367.474 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 8.81 | -67.53 | 0 | 5 | -1 | 62 | 366.466 | 5 | ↓ |