General Information of the Compound
| Compound ID |
CP0569369
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| Compound Name |
tert-butyl N-[4-[5-carbamoyl-2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]benzimidazol-1-yl]butyl]carbamate
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| Structure |
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| Formula |
C24H33N7O4
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| Molecular Weight |
483.573
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| Canonical SMILES |
CCn1nc(C)cc1C(=O)Nc1nc2cc(ccc2n1CCCCNC(=O)OC(C)(C)C)C(N)=O
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| InChI |
InChI=1S/C24H33N7O4/c1-6-31-19(13-15(2)29-31)21(33)28-22-27-17-14-16(20(25)32)9-10-18(17)30(22)12-8-7-11-26-23(34)35-24(3,4)5/h9-10,13-14H,6-8,11-12H2,1-5H3,(H2,25,32)(H,26,34)(H,27,28,33)
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| InChIKey |
MPJIVKZUCVOHHJ-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