General Information of the Compound
| Compound ID |
CP0549906
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| Compound Name |
US9200001, 9
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| Structure |
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| Formula |
C24H23N7OS
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| Molecular Weight |
457.563
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| Canonical SMILES |
Cc1nc(Cc2nc(C)sc2C)n(n1)-c1cc(OCc2ccc3ccccc3n2)nc(C)n1
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| InChI |
InChI=1S/C24H23N7OS/c1-14-21(28-17(4)33-14)11-22-26-16(3)30-31(22)23-12-24(27-15(2)25-23)32-13-19-10-9-18-7-5-6-8-20(18)29-19/h5-10,12H,11,13H2,1-4H3
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| InChIKey |
ZRTCOEXBTSMIGN-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