General Information of the Compound
| Compound ID |
CP0095353
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| Compound Name |
1-(Methylsulfonyl)-N-(2-phenylpyrimidin-4-yl)-1,2-dihydro-1'H-spiro[indole-3,4'-piperidine]-1'-carboxamide
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| Structure |
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| Formula |
C24H25N5O3S
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| Molecular Weight |
463.563
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| Canonical SMILES |
CS(=O)(=O)N1CC2(CCN(CC2)C(=O)Nc2ccnc(n2)-c2ccccc2)c2ccccc12
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| InChI |
InChI=1S/C24H25N5O3S/c1-33(31,32)29-17-24(19-9-5-6-10-20(19)29)12-15-28(16-13-24)23(30)27-21-11-14-25-22(26-21)18-7-3-2-4-8-18/h2-11,14H,12-13,15-17H2,1H3,(H,25,26,27,30)
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| InChIKey |
PTJRIGCPCSVSQH-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