General Information of the Compound
| Compound ID |
CP0356271
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| Compound Name |
CHEMBL2152422
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| Formula |
C15H19N5O2S
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| Molecular Weight |
333.417
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| Canonical SMILES |
CS(=O)(=O)N[C@H]1CC[C@@H](CC1)n1cnc2cnc3[nH]ccc3c12
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| InChI |
InChI=1S/C15H19N5O2S/c1-23(21,22)19-10-2-4-11(5-3-10)20-9-18-13-8-17-15-12(14(13)20)6-7-16-15/h6-11,19H,2-5H2,1H3,(H,16,17)/t10-,11-
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| InChIKey |
OCYXVFJMRUCGMA-XYPYZODXSA-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