General Information of the Compound
| Compound ID |
CP0567713
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| Compound Name |
US11518779, Compound 10
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| Structure |
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| Formula |
C20H27N9O7
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| Molecular Weight |
505.492
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| Canonical SMILES |
Nc1nc(=O)n(cc1CNC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)[C@H]1C[C@H](O)[C@@H](CO)O1
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| InChI |
InChI=1S/C20H27N9O7/c21-16-8(4-28(20(34)27-16)12-1-9(31)11(5-30)35-12)2-23-3-10-14(32)15(33)19(36-10)29-7-26-13-17(22)24-6-25-18(13)29/h4,6-7,9-12,14-15,19,23,30-33H,1-3,5H2,(H2,21,27,34)(H2,22,24,25)/t9-,10+,11+,12+,14+,15+,19+/m0/s1
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| InChIKey |
WLNFAZVETQRDTE-SLFMBYJQSA-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