In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 29 | No |
Popular Name: (5R)-4-benzoyl-1-(2-diethylaminoethyl)-3-hydroxy-5-(p-tolyl)-5H-pyrrol-2-one (5R)-4-benzoyl-1-(2-diethylamino…
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) | 3.61 | 12.04 | -71.04 | 1 | 5 | 0 | 65 | 392.499 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 9.84 | -59.57 | 0 | 5 | -1 | 64 | 391.491 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.61 | 11.22 | -49.43 | 2 | 5 | 1 | 62 | 393.507 | 8 | ↓ |