In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 28 | No |
Popular Name: 5-(4-bromophenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(3-methoxypropyl)-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) | 4.12 | 9.87 | -34.97 | 0 | 5 | -1 | 70 | 463.735 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 9.48 | -18.51 | 0 | 5 | 0 | 64 | 464.743 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.57 | 8.47 | -27.12 | 1 | 5 | 0 | 67 | 464.743 | 6 | ↓ |