General Information of the Compound
| Compound ID |
CP0915693
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| Compound Name |
N-((3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl)-3-(5,6,7-trifluoro-2-(4-fluorophenyl)-1H-indol-3-yl)propanamide
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| Structure |
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| Formula |
C21H17F4N3O3
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| Molecular Weight |
435.377
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| Canonical SMILES |
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2c(F)c(F)c(F)cc12)N[C@@H]1C(=O)NC[C@H]1O
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| InChI |
InChI=1S/C21H17F4N3O3/c22-10-3-1-9(2-4-10)18-11(12-7-13(23)16(24)17(25)19(12)28-18)5-6-15(30)27-20-14(29)8-26-21(20)31/h1-4,7,14,20,28-29H,5-6,8H2,(H,26,31)(H,27,30)/t14-,20+/m1/s1
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| InChIKey |
RKKFMUJQZIIHBZ-VLIAUNLRSA-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