General Information of the Compound
| Compound ID |
CP0561409
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| Compound Name |
2-[(3,5-dichloropyridin-4-yl)amino]-7-methyl-N-(3-methylbutyl)-3H-furo[3,2-e]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C21H21Cl2N5O2
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| Molecular Weight |
446.338
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| Canonical SMILES |
CC(C)CCNC(=O)c1cc2nc(Nc3c(Cl)cncc3Cl)[nH]c2c2cc(C)oc12
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| InChI |
InChI=1S/C21H21Cl2N5O2/c1-10(2)4-5-25-20(29)13-7-16-17(12-6-11(3)30-19(12)13)27-21(26-16)28-18-14(22)8-24-9-15(18)23/h6-10H,4-5H2,1-3H3,(H,25,29)(H2,24,26,27,28)
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| InChIKey |
ZQULTTQGHABYEE-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