General Information of the Compound
| Compound ID |
CP0488020
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| Compound Name |
5-amino-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl)-7,11-dimethyl-3-thia-1,10-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene-4-carboxamide
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| Structure |
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| Formula |
C20H19N5OS
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| Molecular Weight |
377.473
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| Canonical SMILES |
Cc1cn2c(cc(C)c3c(N)c(sc23)C(=O)NC2Cc3cccnc3C2)n1
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| InChI |
InChI=1S/C20H19N5OS/c1-10-6-15-23-11(2)9-25(15)20-16(10)17(21)18(27-20)19(26)24-13-7-12-4-3-5-22-14(12)8-13/h3-6,9,13H,7-8,21H2,1-2H3,(H,24,26)
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| InChIKey |
BAYRNIMPWMTFSK-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