General Information of the Compound
| Compound ID |
CP0950477
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| Compound Name |
3-[2-(4-cyanophenyl)-5,7-difluoro-1H-indol-3-yl]-N-[(3S)-2-oxopyrrolidin-3-yl]propanamide
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| Structure |
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| Formula |
C22H18F2N4O2
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| Molecular Weight |
408.408
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| Canonical SMILES |
N#Cc1ccc(-c2[nH]c3c(F)cc(F)cc3c2CCC(=O)N[C@H]2CCNC2=O)cc1
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| InChI |
InChI=1S/C22H18F2N4O2/c23-14-9-16-15(5-6-19(29)27-18-7-8-26-22(18)30)20(28-21(16)17(24)10-14)13-3-1-12(11-25)2-4-13/h1-4,9-10,18,28H,5-8H2,(H,26,30)(H,27,29)/t18-/m0/s1
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| InChIKey |
WJPMVVYPNLGJLY-SFHVURJKSA-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