General Information of the Compound
| Compound ID |
CP0507249
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| Compound Name |
2-(2-amino-3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl)propanamido)-5-(3-fluorophenyl)cyclohex-1-enecarboxylic acid
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| Structure |
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| Formula |
C23H21F2N5O4
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| Molecular Weight |
469.448
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| Canonical SMILES |
NC(Cc1nc(no1)-c1ccc(F)cn1)C(=O)NC1=C(CC(CC1)c1cccc(F)c1)C(O)=O
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| InChI |
InChI=1S/C23H21F2N5O4/c24-14-3-1-2-12(8-14)13-4-6-18(16(9-13)23(32)33)28-22(31)17(26)10-20-29-21(30-34-20)19-7-5-15(25)11-27-19/h1-3,5,7-8,11,13,17H,4,6,9-10,26H2,(H,28,31)(H,32,33)
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| InChIKey |
SVSZUQREUVBVAY-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