General Information of the Compound
| Compound ID |
CP0528722
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| Compound Name |
2-phenyl-5-(1-(2-(pyrrolidin-1-yl)ethyl)-1H-indazol-5-yl)furo[3,2-c]pyridin-4(5H)-one
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| Structure |
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| Formula |
C26H24N4O2
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| Molecular Weight |
424.504
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| Canonical SMILES |
O=c1n(ccc2oc(cc12)-c1ccccc1)-c1ccc2n(CCN3CCCC3)ncc2c1
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| InChI |
InChI=1S/C26H24N4O2/c31-26-22-17-25(19-6-2-1-3-7-19)32-24(22)10-13-29(26)21-8-9-23-20(16-21)18-27-30(23)15-14-28-11-4-5-12-28/h1-3,6-10,13,16-18H,4-5,11-12,14-15H2
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| InChIKey |
AZTUEMJLQCTRMN-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