In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 32 | No |
Popular Name: 5-(2,4-dimethoxyphenyl)-1-hexyl-3-hydroxy-4-(4-methylbenzoyl)-5H-pyrrol-2-one 5-(2,4-dimethoxyphenyl)-1-hexyl-…
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) | 5.32 | 11.49 | -57.01 | 0 | 6 | -1 | 79 | 436.528 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.73 | 11 | -17.86 | 0 | 6 | 0 | 73 | 437.536 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.76 | 10.02 | -25.69 | 1 | 6 | 0 | 76 | 437.536 | 9 | ↓ |