General Information of the Compound
| Compound ID |
CP0513755
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| Compound Name |
3-(pyrido[2,3-d]pyrimidin-2-yl)benzonitrile
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| Structure |
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| Formula |
C14H8N4
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| Molecular Weight |
232.246
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| Canonical SMILES |
N#Cc1cccc(c1)-c1ncc2cccnc2n1
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| InChI |
InChI=1S/C14H8N4/c15-8-10-3-1-4-11(7-10)13-17-9-12-5-2-6-16-14(12)18-13/h1-7,9H
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| InChIKey |
CNRGHCUPQZWRBI-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