In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2006 | 29 | No |
Popular Name: 4-(4-chlorobenzoyl)-3-hydroxy-5-(4-isopropylphenyl)-1-(2-methoxyethyl)-5H-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) | 4.55 | 9.66 | -59.51 | 0 | 5 | -1 | 70 | 412.893 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.00 | 8.55 | -28.82 | 1 | 5 | 0 | 67 | 413.901 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.97 | 9.54 | -22.38 | 0 | 5 | 0 | 64 | 413.901 | 7 | ↓ |