In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2007 | 29 | No |
Popular Name: 4-(4-bromobenzoyl)-5-(3,4-dichlorophenyl)-3-hydroxy-1-thiazol-2-yl-5H-pyrrol-2-one 4-(4-bromobenzoyl)-5-(3,4-dichlo…
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) | 5.22 | 10.63 | -45.3 | 0 | 5 | -1 | 73 | 509.188 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.67 | 9.67 | -22.52 | 1 | 5 | 0 | 71 | 510.196 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.64 | 10.64 | -14.84 | 0 | 5 | 0 | 67 | 510.196 | 4 | ↓ |