In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2007 | 28 | No |
Popular Name: 5-(3-bromophenyl)-3-hydroxy-4-(4-methoxybenzoyl)-1-(2-methoxyethyl)-5H-pyrrol-2-one 5-(3-bromophenyl)-3-hydroxy-4-(4…
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) | 3.20 | 7.21 | -55.73 | 0 | 6 | -1 | 79 | 445.289 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 7.53 | -20.15 | 0 | 6 | 0 | 73 | 446.297 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.65 | 6.53 | -28.24 | 1 | 6 | 0 | 76 | 446.297 | 6 | ↓ |