General Information of the Compound
| Compound ID |
CP0560251
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| Compound Name |
N,N-diethyl-5-methyl-1-(2H-triazol-4-ylmethyl)indole-2-carboxamide
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| Formula |
C17H21N5O
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| Molecular Weight |
311.389
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| Canonical SMILES |
CCN(CC)C(=O)c1cc2cc(C)ccc2n1Cc1cn[nH]n1
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| InChI |
InChI=1S/C17H21N5O/c1-4-21(5-2)17(23)16-9-13-8-12(3)6-7-15(13)22(16)11-14-10-18-20-19-14/h6-10H,4-5,11H2,1-3H3,(H,18,19,20)
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| InChIKey |
MLXKXDSAWDKXHP-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