In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2009 | 29 | No |
Popular Name: (2R)-3-benzoyl-4-hydroxy-2-(3-nitrophenyl)-1-(1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one (2R)-3-benzoyl-4-hydroxy-2-(3-ni…
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) | 2.73 | 9 | -49.89 | 0 | 9 | -1 | 132 | 407.387 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 8.17 | -17.53 | 1 | 9 | 0 | 129 | 408.395 | 5 | ↓ |