General Information of the Compound
| Compound ID |
CP0374256
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| Compound Name |
2-(2-amino-3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl)propanamido)-5-(2,3,5-trifluorophenyl)cyclohex-1-enecarboxylic acid
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| Structure |
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| Formula |
C23H19F4N5O4
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| Molecular Weight |
505.428
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| Canonical SMILES |
NC(Cc1nc(no1)-c1ccc(F)cn1)C(=O)NC1=C(CC(CC1)c1cc(F)cc(F)c1F)C(O)=O
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| InChI |
InChI=1S/C23H19F4N5O4/c24-11-2-4-18(29-9-11)21-31-19(36-32-21)8-16(28)22(33)30-17-3-1-10(5-14(17)23(34)35)13-6-12(25)7-15(26)20(13)27/h2,4,6-7,9-10,16H,1,3,5,8,28H2,(H,30,33)(H,34,35)
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| InChIKey |
HWMSFDDABVZFCQ-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