In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 26 | No |
Popular Name: (5R)-4-benzoyl-1-(2-dimethylaminoethyl)-3-hydroxy-5-(5-methyl-2-furyl)-5H-pyrrol-2-one (5R)-4-benzoyl-1-(2-dimethylamin…
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) | 1.89 | 8.38 | -74 | 1 | 6 | 0 | 78 | 354.406 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 5.86 | -61.32 | 0 | 6 | -1 | 77 | 353.398 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 7.56 | -50.23 | 2 | 6 | 1 | 75 | 355.414 | 6 | ↓ |