In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 25 | Yes |
Popular Name: 3-[3-(1,3-Benzodioxol-5-yl)-1-phenyl-1H-pyrazol-4-yl]propanoic acid 3-[3-(1,3-Benzodioxol-5-yl)-1-ph…
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CAS Numbers: , 1171384-62-5
1H-pyrazole-4-propanoic acid, 3-(1,3-benzodioxol-5-yl)-1-phenyl-
3-[3-(1,3-benzodioxol-5-yl)-1-phenyl-1h-pyrazol-4-yl]propanoicacid
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) | 3.10 | 9.87 | -49.62 | 0 | 6 | -1 | 76 | 335.339 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |