General Information of the Compound
| Compound ID |
CP0903186
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| Compound Name |
SID3712382
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| Structure |
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| Formula |
C18H14N6OS2
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| Molecular Weight |
394.485
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| Canonical SMILES |
CCn1c2ccccc2c2nnc(SCc3cc(=O)n4ccsc4n3)nc21
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| InChI |
InChI=1S/C18H14N6OS2/c1-2-23-13-6-4-3-5-12(13)15-16(23)20-17(22-21-15)27-10-11-9-14(25)24-7-8-26-18(24)19-11/h3-9H,2,10H2,1H3
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| InChIKey |
LYNKIXXNSUSILQ-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