General Information of the Compound
| Compound ID |
CP0967286
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| Compound Name |
trans-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(3R)-2,5-dioxopyrrolidin-3-yl]cyclobutanecarboxamide
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| Formula |
C23H18F3N3O3
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| Molecular Weight |
441.409
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| Canonical SMILES |
O=C1C[C@@H](NC(=O)[C@H]2C[C@H](c3c(-c4ccc(F)cc4)[nH]c4c(F)cc(F)cc43)C2)C(=O)N1
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| InChI |
InChI=1S/C23H18F3N3O3/c24-13-3-1-10(2-4-13)20-19(15-7-14(25)8-16(26)21(15)29-20)11-5-12(6-11)22(31)27-17-9-18(30)28-23(17)32/h1-4,7-8,11-12,17,29H,5-6,9H2,(H,27,31)(H,28,30,32)/t11-,12-,17-/m1/s1
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| InChIKey |
JDTHXJPLCKPVAA-PSTGCABASA-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