General Information of the Compound
| Compound ID |
CP0406851
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| Compound Name |
US9145419, 34
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| Structure |
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| Formula |
C18H12Cl2N4
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| Molecular Weight |
355.228
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| Canonical SMILES |
Cc1ccncc1-c1ccnn2c(cnc12)-c1cc(Cl)cc(Cl)c1
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| InChI |
InChI=1S/C18H12Cl2N4/c1-11-2-4-21-9-16(11)15-3-5-23-24-17(10-22-18(15)24)12-6-13(19)8-14(20)7-12/h2-10H,1H3
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| InChIKey |
PYWFJDTXDXPMHK-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