General Information of the Compound
| Compound ID |
CP0570122
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| Compound Name |
2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1-[4-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]butyl]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C26H33N9O3
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| Molecular Weight |
519.61
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| Canonical SMILES |
CCn1nc(C)cc1C(=O)NCCCCn1c(NC(=O)c2cc(C)nn2CC)nc2cc(ccc12)C(N)=O
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| InChI |
InChI=1S/C26H33N9O3/c1-5-34-21(13-16(3)31-34)24(37)28-11-7-8-12-33-20-10-9-18(23(27)36)15-19(20)29-26(33)30-25(38)22-14-17(4)32-35(22)6-2/h9-10,13-15H,5-8,11-12H2,1-4H3,(H2,27,36)(H,28,37)(H,29,30,38)
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| InChIKey |
FNHVALOQCAKXKR-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