In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 28 | No |
Popular Name: (2S)-4-hydroxy-3-(4-isobutoxybenzoyl)-2-[(E)-styryl]-1,2-dihydropyrrol-5-one (2S)-4-hydroxy-3-(4-isobutoxyben…
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) | 4.07 | 7.8 | -55.8 | 1 | 5 | -1 | 78 | 376.432 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.07 | 7.03 | -12.74 | 2 | 5 | 0 | 76 | 377.44 | 7 | ↓ |