General Information of the Compound
| Compound ID |
CP0514988
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| Compound Name |
US9216182, 1.82
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| Structure |
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| Formula |
C19H28N4O4S
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| Molecular Weight |
408.524
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| Canonical SMILES |
COC(=O)c1cnc(s1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
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| InChI |
InChI=1S/C19H28N4O4S/c1-26-17(24)16-13-20-18(28-16)22-7-5-15(6-8-22)27-19(25)23-11-9-21(10-12-23)14-3-2-4-14/h13-15H,2-12H2,1H3
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| InChIKey |
UFTNAXNUWXXCFQ-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