General Information of the Compound
| Compound ID |
CP0968636
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| Compound Name |
N-((3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl)-3-(2-phenyl-7-vinyl-1H-indol-3-yl)propanamide
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| Structure |
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| Formula |
C23H23N3O3
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| Molecular Weight |
389.455
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| Canonical SMILES |
C=Cc1cccc2c(CCC(=O)N[C@@H]3C(=O)NC[C@H]3O)c(-c3ccccc3)[nH]c12
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| InChI |
InChI=1S/C23H23N3O3/c1-2-14-9-6-10-16-17(21(26-20(14)16)15-7-4-3-5-8-15)11-12-19(28)25-22-18(27)13-24-23(22)29/h2-10,18,22,26-27H,1,11-13H2,(H,24,29)(H,25,28)/t18-,22+/m1/s1
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| InChIKey |
UYXINXYFZBLGCE-GCJKJVERSA-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