In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 28 | No |
Popular Name: 4-[(4Z)-4-[(2-hydroxy-3-methoxy-phenyl)methylene]-5-oxo-3-propyl-pyrazol-1-yl]benzoic 4-[(4Z)-4-[(2-hydroxy-3-methoxy-…
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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) | 3.38 | 8.27 | -59.11 | 1 | 7 | -1 | 104 | 379.392 | 6 | ↓ |
Ref Reference (pH 7) | 3.38 | 8.69 | -58.18 | 1 | 7 | -1 | 104 | 379.392 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 9.62 | -99.33 | 0 | 7 | -2 | 107 | 378.384 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 9.19 | -99.35 | 0 | 7 | -2 | 107 | 378.384 | 6 | ↓ |