General Information of the Compound
| Compound ID |
CP0553974
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| Compound Name |
N,N-dimethyl-5-[(8-phenyloctanoylamino)methyl]tetrazole-1-carboxamide
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| Structure |
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| Formula |
C19H28N6O2
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| Molecular Weight |
372.473
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| Canonical SMILES |
CN(C)C(=O)n1nnnc1CNC(=O)CCCCCCCc1ccccc1
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| InChI |
InChI=1S/C19H28N6O2/c1-24(2)19(27)25-17(21-22-23-25)15-20-18(26)14-10-5-3-4-7-11-16-12-8-6-9-13-16/h6,8-9,12-13H,3-5,7,10-11,14-15H2,1-2H3,(H,20,26)
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| InChIKey |
HIADSYTVDMQHFM-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