In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 34 | No |
Popular Name: (2S)-3-(3-benzyloxybenzoyl)-2-(4-ethoxy-3-methoxy-phenyl)-4-hydroxy-1,2-dihydropyrrol-5-one (2S)-3-(3-benzyloxybenzoyl)-2-(4…
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) | 3.78 | 8.35 | -61.37 | 1 | 7 | -1 | 97 | 458.49 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.78 | 7.58 | -19.74 | 2 | 7 | 0 | 94 | 459.498 | 9 | ↓ |