General Information of the Compound
| Compound ID |
CP0201030
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| Compound Name |
1-(2-chlorophenyl)-1-(2,6-dimethyl-1H-indol-3-yl)-N-[(4-methylphenyl)methyl]methanamine
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| Structure |
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| Formula |
C25H25ClN2
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| Molecular Weight |
388.942
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| Canonical SMILES |
Cc1[nH]c2cc(C)ccc2c1C(NCc1ccc(C)cc1)c1ccccc1Cl
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| InChI |
InChI=1S/C25H25ClN2/c1-16-8-11-19(12-9-16)15-27-25(20-6-4-5-7-22(20)26)24-18(3)28-23-14-17(2)10-13-21(23)24/h4-14,25,27-28H,15H2,1-3H3
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| InChIKey |
HKAUCVLSMSXIQN-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