General Information of the Compound
| Compound ID |
CP0543304
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| Compound Name |
9-[3-(4,6-dimethylpyrimidin-2-yl)oxypropyl]-5,6,7,8-tetrahydrocarbazole-3-carbonitrile
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| Structure |
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| Formula |
C22H24N4O
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| Molecular Weight |
360.461
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| Canonical SMILES |
Cc1cc(C)nc(OCCCn2c3CCCCc3c3cc(ccc23)C#N)n1
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| InChI |
InChI=1S/C22H24N4O/c1-15-12-16(2)25-22(24-15)27-11-5-10-26-20-7-4-3-6-18(20)19-13-17(14-23)8-9-21(19)26/h8-9,12-13H,3-7,10-11H2,1-2H3
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| InChIKey |
PZJPSSQXPMWTRD-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