General Information of the Compound
| Compound ID |
CP0305900
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| Compound Name |
1-(3-amino-3-oxopropyl)-2-benzamido-N-cyclohexyl-N-prop-2-enylbenzimidazole-5-carboxamide
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| Structure |
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| Formula |
C27H31N5O3
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| Molecular Weight |
473.577
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| Canonical SMILES |
NC(=O)CCn1c(NC(=O)c2ccccc2)nc2cc(ccc12)C(=O)N(CC=C)C1CCCCC1
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| InChI |
InChI=1S/C27H31N5O3/c1-2-16-31(21-11-7-4-8-12-21)26(35)20-13-14-23-22(18-20)29-27(32(23)17-15-24(28)33)30-25(34)19-9-5-3-6-10-19/h2-3,5-6,9-10,13-14,18,21H,1,4,7-8,11-12,15-17H2,(H2,28,33)(H,29,30,34)
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| InChIKey |
GIRDQOYFXWGMLW-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