General Information of the Compound
| Compound ID |
CP0398946
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| Compound Name |
2-(1-(methylsulfonyl)spiro[indoline-3,4'-piperidine]-1'-yl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C20H22N4O2S
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| Molecular Weight |
382.489
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| Canonical SMILES |
CS(=O)(=O)N1CC2(CCN(CC2)c2nc3ccccc3[nH]2)c2ccccc12
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| InChI |
InChI=1S/C20H22N4O2S/c1-27(25,26)24-14-20(15-6-2-5-9-18(15)24)10-12-23(13-11-20)19-21-16-7-3-4-8-17(16)22-19/h2-9H,10-14H2,1H3,(H,21,22)
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| InChIKey |
DFRJFLMARWUQQJ-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