General Information of the Compound
| Compound ID |
CP0533522
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| Compound Name |
4-fluoro-N-[1-[1-(2-methylpyrimidin-4-yl)spiro[2H-pyrrolo[3,2-b]pyridine-3,1'-cyclopropane]-5-yl]cyclopropyl]benzamide
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| Formula |
C24H22FN5O
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| Molecular Weight |
415.472
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| Canonical SMILES |
Cc1nccc(n1)N1CC2(CC2)c2nc(ccc12)C1(CC1)NC(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C24H22FN5O/c1-15-26-13-8-20(27-15)30-14-23(9-10-23)21-18(30)6-7-19(28-21)24(11-12-24)29-22(31)16-2-4-17(25)5-3-16/h2-8,13H,9-12,14H2,1H3,(H,29,31)
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| InChIKey |
XBBATSURWHVGPV-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