General Information of the Compound
| Compound ID |
CP0557415
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| Compound Name |
US9150519, 1-11
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| Structure |
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| Formula |
C17H18Cl2N4O2
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| Molecular Weight |
381.263
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| Canonical SMILES |
Oc1c(Cl)cc(NC(=O)c2cc(NC3CCCCC3)ncn2)cc1Cl
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| InChI |
InChI=1S/C17H18Cl2N4O2/c18-12-6-11(7-13(19)16(12)24)23-17(25)14-8-15(21-9-20-14)22-10-4-2-1-3-5-10/h6-10,24H,1-5H2,(H,23,25)(H,20,21,22)
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| InChIKey |
KMCAFOMLNKKONR-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