General Information of the Compound
| Compound ID |
CP0874435
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| Compound Name |
(5-(1-Methyl-1H-pyrazol-4-yl)-1H-indol-2-yl)methanamine
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| Structure |
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| Formula |
C13H14N4
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| Molecular Weight |
226.283
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| Canonical SMILES |
Cn1cc(-c2ccc3[nH]c(CN)cc3c2)cn1
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| InChI |
InChI=1S/C13H14N4/c1-17-8-11(7-15-17)9-2-3-13-10(4-9)5-12(6-14)16-13/h2-5,7-8,16H,6,14H2,1H3
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| InChIKey |
ASMYDHMZPLEECI-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