In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2008 | 26 | No |
Popular Name: 1-allyl-5-(2-chlorophenyl)-3-hydroxy-4-(4-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one 1-allyl-5-(2-chlorophenyl)-3-hyd…
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) | 4.10 | 10.05 | -57.09 | 0 | 4 | -1 | 60 | 366.824 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 10.39 | -10.61 | 0 | 4 | 0 | 54 | 367.832 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 10.07 | -10.55 | 1 | 4 | 0 | 58 | 367.832 | 5 | ↓ |