In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2007 | 27 | No |
Popular Name: 5-(4-bromophenyl)-1-butyl-4-(4-chlorobenzoyl)-3-hydroxy-5H-pyrrol-2-one 5-(4-bromophenyl)-1-butyl-4-(4-c…
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) | 5.30 | 11.11 | -52.47 | 0 | 4 | -1 | 60 | 447.736 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.72 | 10.68 | -20.29 | 0 | 4 | 0 | 54 | 448.744 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.75 | 9.69 | -26.41 | 1 | 4 | 0 | 58 | 448.744 | 5 | ↓ |