In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 27 | No |
Popular Name: 5-(4-bromophenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(3-hydroxypropyl)-5H-pyrrol-2-one 5-(4-bromophenyl)-4-(4-chloroben…
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) | 3.50 | 7.44 | -37.57 | 1 | 5 | -1 | 81 | 449.708 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 6.07 | -28 | 2 | 5 | 0 | 78 | 450.716 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.92 | -3.32 | -20.84 | 1 | 5 | 0 | 74 | 450.716 | 6 | ↓ |