In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 30 | No |
Popular Name: (2S)-4-hydroxy-2-phenyl-3-[(Z)-3-phenylprop-2-enoyl]-1-(p-tolyl)-2H-pyrrol-5-one (2S)-4-hydroxy-2-phenyl-3-[(Z)-3…
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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) | 4.90 | 13.31 | -63.6 | 0 | 4 | -1 | 60 | 394.45 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.90 | 12.42 | -14.38 | 1 | 4 | 0 | 58 | 395.458 | 5 | ↓ |