In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 28 | No |
Popular Name: 4-(4-chlorobenzoyl)-5-(3-chlorophenyl)-3-hydroxy-1-(3-methoxypropyl)-5H-pyrrol-2-one 4-(4-chlorobenzoyl)-5-(3-chlorop…
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) | 3.97 | 9.34 | -36.78 | 0 | 5 | -1 | 70 | 419.284 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 8.87 | -25.44 | 0 | 5 | 0 | 64 | 420.292 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.41 | 7.88 | -30.79 | 1 | 5 | 0 | 67 | 420.292 | 6 | ↓ |