General Information of the Compound
| Compound ID |
CP0416652
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| Compound Name |
tert-butyl N-[2-[2-[(E)-2-(4-tert-butylphenyl)ethenyl]-3H-benzimidazol-5-yl]phenyl]carbamate
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| Structure |
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| Formula |
C30H33N3O2
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| Molecular Weight |
467.613
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| Canonical SMILES |
CC(C)(C)OC(=O)Nc1ccccc1-c1ccc2[nH]c(\C=C\c3ccc(cc3)C(C)(C)C)nc2c1
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| InChI |
InChI=1S/C30H33N3O2/c1-29(2,3)22-15-11-20(12-16-22)13-18-27-31-25-17-14-21(19-26(25)32-27)23-9-7-8-10-24(23)33-28(34)35-30(4,5)6/h7-19H,1-6H3,(H,31,32)(H,33,34)/b18-13+
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| InChIKey |
NWCRPUDZGTWWAP-QGOAFFKASA-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