General Information of the Compound
Compound ID |
CP0911424
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Compound Name |
5-(3-acrylamidophenyl)-2-(2-hydroxypropan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-8-carboxamide
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Structure |
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Formula |
C25H27N3O3
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Molecular Weight |
417.509
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Canonical SMILES |
C=CC(=O)Nc1cccc(-c2ccc(C(N)=O)c3[nH]c4c(c23)CCC(C(C)(C)O)C4)c1
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InChI |
InChI=1S/C25H27N3O3/c1-4-21(29)27-16-7-5-6-14(12-16)17-10-11-19(24(26)30)23-22(17)18-9-8-15(25(2,3)31)13-20(18)28-23/h4-7,10-12,15,28,31H,1,8-9,13H2,2-3H3,(H2,26,30)(H,27,29)
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InChIKey |
GPYZDEKHMXWLRD-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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