General Information of the Compound
| Compound ID |
CP0499941
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| Compound Name |
(R)-N-(5-guanidino-1-oxo-1-(4-(trifluoromethyl)benzylamino)pentan-2-yl)-7-methoxybenzofuran-2-carboxamide
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| Structure |
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| Formula |
C24H26F3N5O4
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| Molecular Weight |
505.497
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| Canonical SMILES |
COc1cccc2cc(oc12)C(=O)N[C@H](CCCNC(N)=N)C(=O)NCc1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C24H26F3N5O4/c1-35-18-6-2-4-15-12-19(36-20(15)18)22(34)32-17(5-3-11-30-23(28)29)21(33)31-13-14-7-9-16(10-8-14)24(25,26)27/h2,4,6-10,12,17H,3,5,11,13H2,1H3,(H,31,33)(H,32,34)(H4,28,29,30)/t17-/m1/s1
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| InChIKey |
CJPYBFNPFUDPAW-QGZVFWFLSA-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