In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 27 | No |
Popular Name: (2R)-4-hydroxy-1-(2-hydroxyethyl)-3-(4-methylbenzoyl)-2-[(E)-styryl]-2H-pyrrol-5-one (2R)-4-hydroxy-1-(2-hydroxyethyl…
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) | 2.95 | 6.81 | -61.64 | 1 | 5 | -1 | 81 | 362.405 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 6.06 | -13.09 | 2 | 5 | 0 | 78 | 363.413 | 6 | ↓ |