General Information of the Compound
| Compound ID |
CP0947851
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| Compound Name |
SID103163397
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| Structure |
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| Formula |
C23H19ClN4O2
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| Molecular Weight |
418.884
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| Canonical SMILES |
CN(C)C(=O)c1cccc(-c2cnc3c(NC=O)cc(-c4ccccc4Cl)cn23)c1
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| InChI |
InChI=1S/C23H19ClN4O2/c1-27(2)23(30)16-7-5-6-15(10-16)21-12-25-22-20(26-14-29)11-17(13-28(21)22)18-8-3-4-9-19(18)24/h3-14H,1-2H3,(H,26,29)
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| InChIKey |
IJLQYSJFCYJVNR-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