General Information of the Compound
| Compound ID |
CP0116609
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| Compound Name |
5-[3-(6-propan-2-yloxypyrazin-2-yl)-1H-indol-5-yl]-1,3,4-thiadiazol-2-amine
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| Structure |
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| Formula |
C17H16N6OS
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| Molecular Weight |
352.423
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| Canonical SMILES |
CC(C)Oc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
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| InChI |
InChI=1S/C17H16N6OS/c1-9(2)24-15-8-19-7-14(21-15)12-6-20-13-4-3-10(5-11(12)13)16-22-23-17(18)25-16/h3-9,20H,1-2H3,(H2,18,23)
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| InChIKey |
DSXHSERBBFHDMQ-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