General Information of the Compound
| Compound ID |
CP0225244
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| Compound Name |
4-[5-amino-3-(furan-2-yl)pyrazol-1-yl]benzoic acid
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| Formula |
C14H11N3O3
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| Molecular Weight |
269.26
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| Canonical SMILES |
Nc1cc(nn1-c1ccc(cc1)C(O)=O)-c1ccco1
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| InChI |
InChI=1S/C14H11N3O3/c15-13-8-11(12-2-1-7-20-12)16-17(13)10-5-3-9(4-6-10)14(18)19/h1-8H,15H2,(H,18,19)
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| InChIKey |
UWKSMHQOFVJHOW-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound