General Information of the Compound
| Compound ID |
CP0956783
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| Compound Name |
SID17511441
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| Structure |
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| Formula |
C19H18ClN3O2
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| Molecular Weight |
355.825
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| Canonical SMILES |
CCOC(=O)N/N=C/c1cn(Cc2ccc(Cl)cc2)c2ccccc12
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| InChI |
InChI=1S/C19H18ClN3O2/c1-2-25-19(24)22-21-11-15-13-23(18-6-4-3-5-17(15)18)12-14-7-9-16(20)10-8-14/h3-11,13H,2,12H2,1H3,(H,22,24)/b21-11+
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| InChIKey |
AGWKHIWEYSEOCL-SRZZPIQSSA-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