General Information of the Compound
| Compound ID |
CP0947579
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| Compound Name |
SID17510497
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| Structure |
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| Formula |
C21H27N5O
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| Molecular Weight |
365.481
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| Canonical SMILES |
Cc1cccc(NC(=O)CC23CC4CC(C2)CC(n2nnc(C)n2)(C4)C3)c1
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| InChI |
InChI=1S/C21H27N5O/c1-14-4-3-5-18(6-14)22-19(27)12-20-8-16-7-17(9-20)11-21(10-16,13-20)26-24-15(2)23-25-26/h3-6,16-17H,7-13H2,1-2H3,(H,22,27)
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| InChIKey |
MZGTTXPXJJBPAC-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