In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 30 | No |
Popular Name: (2S)-1-butyl-3-(3-fluoro-4-methyl-benzoyl)-4-hydroxy-2-(3-nitrophenyl)-2H-pyrrol-5-one (2S)-1-butyl-3-(3-fluoro-4-methy…
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) | 4.29 | 11 | -52.58 | 0 | 7 | -1 | 106 | 411.409 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.29 | 10.25 | -15.82 | 1 | 7 | 0 | 103 | 412.417 | 7 | ↓ |