General Information of the Compound
| Compound ID |
CP0344230
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| Compound Name |
US11471446, Compound DBA-6
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| Structure |
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| Formula |
C19H21N5OS
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| Molecular Weight |
367.478
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| Canonical SMILES |
NC(=O)c1sc2nccc(N3CCCN(CC3)c3ccccc3)c2c1N
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| InChI |
InChI=1S/C19H21N5OS/c20-16-15-14(7-8-22-19(15)26-17(16)18(21)25)24-10-4-9-23(11-12-24)13-5-2-1-3-6-13/h1-3,5-8H,4,9-12,20H2,(H2,21,25)
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| InChIKey |
DEXAFBASLBZBIA-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