In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 29 | No |
Popular Name: (2R)-3-benzoyl-2-(3-bromophenyl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2H-pyrrol-5-one (2R)-3-benzoyl-2-(3-bromophenyl)…
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) | 3.86 | 10.43 | -52.04 | 0 | 6 | -1 | 86 | 469.34 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 9.67 | -12.26 | 1 | 6 | 0 | 83 | 470.348 | 5 | ↓ |