In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2008 | 25 | No |
Popular Name: 1-allyl-4-benzoyl-5-(2-chlorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one 1-allyl-4-benzoyl-5-(2-chlorophe…
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) | 3.65 | 9.95 | -58.65 | 0 | 4 | -1 | 60 | 352.797 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 9.54 | -9.06 | 0 | 4 | 0 | 54 | 353.805 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 8.17 | -24.23 | 1 | 4 | 0 | 58 | 353.805 | 4 | ↓ |