In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 27 | No |
Popular Name: 3-[(4Z)-4-[(4-hydroxy-3-iodo-5-methoxy-phenyl)methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic 3-[(4Z)-4-[(4-hydroxy-3-iodo-5-m…
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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) | 3.53 | 7.41 | -66.49 | 1 | 7 | -1 | 104 | 477.234 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.53 | 8.16 | -108.02 | 0 | 7 | -2 | 107 | 476.226 | 4 | ↓ |