In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 26 | No |
Popular Name: (2S)-1-allyl-3-(furan-2-carbonyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one (2S)-1-allyl-3-(furan-2-carbonyl…
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) | 2.24 | 7.72 | -56.39 | 0 | 8 | -1 | 119 | 353.31 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.24 | 6.96 | -16.24 | 1 | 8 | 0 | 117 | 354.318 | 6 | ↓ |