General Information of the Compound
| Compound ID |
CP0547874
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| Compound Name |
9-methyl-N-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydrocarbazol-2-amine
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| Structure |
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| Formula |
C21H24N2
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| Molecular Weight |
304.437
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| Canonical SMILES |
Cc1ccc(CNC2CCc3c(C2)n(C)c2ccccc32)cc1
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| InChI |
InChI=1S/C21H24N2/c1-15-7-9-16(10-8-15)14-22-17-11-12-19-18-5-3-4-6-20(18)23(2)21(19)13-17/h3-10,17,22H,11-14H2,1-2H3
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| InChIKey |
SHRJKINVHLWHRC-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