In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2007 | 32 | No |
Popular Name: 4-(4-butoxy-3-methyl-benzoyl)-3-hydroxy-1-(3-methoxypropyl)-5-phenyl-5H-pyrrol-2-one 4-(4-butoxy-3-methyl-benzoyl)-3-…
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) | 4.50 | 10.45 | -61.61 | 0 | 6 | -1 | 79 | 436.528 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.95 | 9.76 | -26.98 | 1 | 6 | 0 | 76 | 437.536 | 10 | ↓ |