General Information of the Compound
| Compound ID |
CP0473271
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| Compound Name |
N-pyridin-3-yl-5-thia-3,11,12-triazatricyclo[8.3.0.02,6]trideca-1(10),2(6),3,12-tetraen-4-amine
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| Structure |
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| Formula |
C14H13N5S
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| Molecular Weight |
283.36
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| Canonical SMILES |
C1Cc2[nH]ncc2-c2nc(Nc3cccnc3)sc2C1
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| InChI |
InChI=1S/C14H13N5S/c1-4-11-10(8-16-19-11)13-12(5-1)20-14(18-13)17-9-3-2-6-15-7-9/h2-3,6-8H,1,4-5H2,(H,16,19)(H,17,18)
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| InChIKey |
RZBNNZQLMKBBNX-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