General Information of the Compound
| Compound ID |
CP0371850
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| Compound Name |
5-tert-butyl-2-(4-tert-butylphenyl)-1H-indole
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| Structure |
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| Formula |
C22H27N
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| Molecular Weight |
305.465
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)-c1cc2cc(ccc2[nH]1)C(C)(C)C
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| InChI |
InChI=1S/C22H27N/c1-21(2,3)17-9-7-15(8-10-17)20-14-16-13-18(22(4,5)6)11-12-19(16)23-20/h7-14,23H,1-6H3
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| InChIKey |
PBUKGCUQLQWIQX-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