General Information of the Compound
| Compound ID |
CP0396616
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| Compound Name |
3-(1,2,3,6-Tetrahydro-pyridin-4-yl)-1H-indole-5-carbonitrile
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| Structure |
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| Formula |
C14H13N3
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| Molecular Weight |
223.279
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| Canonical SMILES |
N#Cc1ccc2[nH]cc(C3=CCNCC3)c2c1
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| InChI |
InChI=1S/C14H13N3/c15-8-10-1-2-14-12(7-10)13(9-17-14)11-3-5-16-6-4-11/h1-3,7,9,16-17H,4-6H2
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| InChIKey |
VADZOZAUGGYKFE-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