General Information of the Compound
| Compound ID |
CP0394336
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| Compound Name |
2-(2-chloro-6-methylanilino)-7,7-dimethyl-N-[5-(trifluoromethyl)pyridin-2-yl]-3,8-dihydrofuro[3,2-e]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C25H21ClF3N5O2
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| Molecular Weight |
515.923
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| Canonical SMILES |
Cc1cccc(Cl)c1Nc1nc2cc(C(=O)Nc3ccc(cn3)C(F)(F)F)c3OC(C)(C)Cc3c2[nH]1
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| InChI |
InChI=1S/C25H21ClF3N5O2/c1-12-5-4-6-16(26)19(12)33-23-31-17-9-14(21-15(20(17)34-23)10-24(2,3)36-21)22(35)32-18-8-7-13(11-30-18)25(27,28)29/h4-9,11H,10H2,1-3H3,(H,30,32,35)(H2,31,33,34)
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| InChIKey |
CMVCWCYAFXJCSR-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