In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 31 | No |
Popular Name: (2S)-3-(4-butoxy-3-methyl-benzoyl)-2-(4-tert-butylphenyl)-4-hydroxy-1,2-dihydropyrrol-5-one (2S)-3-(4-butoxy-3-methyl-benzoy…
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) | 5.71 | 9.88 | -56.23 | 1 | 5 | -1 | 78 | 420.529 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.71 | 9.12 | -12.29 | 2 | 5 | 0 | 76 | 421.537 | 8 | ↓ |