In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 28 | No |
Popular Name: 5-(4-bromophenyl)-1-butyl-3-hydroxy-4-(4-methoxybenzoyl)-5H-pyrrol-2-one 5-(4-bromophenyl)-1-butyl-3-hydr…
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) | 4.68 | 10.42 | -36.83 | 0 | 5 | -1 | 70 | 443.317 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.13 | 8.48 | -27.47 | 1 | 5 | 0 | 67 | 444.325 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 9.46 | -22.2 | 0 | 5 | 0 | 64 | 444.325 | 7 | ↓ |