In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2006 | 24 | No |
Popular Name: 4-(4-chlorobenzoyl)-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one 4-(4-chlorobenzoyl)-3-hydroxy-5-…
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) | 2.87 | 4.92 | -54.49 | 1 | 5 | -1 | 78 | 342.758 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.31 | -2.14 | -17.15 | 2 | 5 | 0 | 75 | 343.766 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.28 | -2.34 | -11.88 | 1 | 5 | 0 | 72 | 343.766 | 4 | ↓ |