General Information of the Compound
| Compound ID |
CP0539342
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| Compound Name |
6-(cyclohexylamino)-N-(1H-indol-5-yl)pyrimidine-4-carboxamide
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| Structure |
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| Formula |
C19H21N5O
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| Molecular Weight |
335.411
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| Canonical SMILES |
O=C(Nc1ccc2[nH]ccc2c1)c1cc(NC2CCCCC2)ncn1
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| InChI |
InChI=1S/C19H21N5O/c25-19(24-15-6-7-16-13(10-15)8-9-20-16)17-11-18(22-12-21-17)23-14-4-2-1-3-5-14/h6-12,14,20H,1-5H2,(H,24,25)(H,21,22,23)
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| InChIKey |
XOEUJDNRYAEWRB-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