In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 14 | Yes |
Popular Name: 2-(4-Bromo-3,5-dimethyl-pyrazol-1-yl)-propionic acid methyl ester 2-(4-Bromo-3,5-dimethyl-pyrazol-…
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CAS Number: 1005566-41-5
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) | 1.79 | 2.11 | -10.76 | 0 | 4 | 0 | 44 | 261.119 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.