General Information of the Compound
| Compound ID |
CP0833617
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| Compound Name |
SID860987
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| Structure |
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| Formula |
C18H22N4O3S
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| Molecular Weight |
374.466
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| Canonical SMILES |
COc1cc(-c2nnc3sc(C4CCCCC4)nn23)cc(OC)c1OC
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| InChI |
InChI=1S/C18H22N4O3S/c1-23-13-9-12(10-14(24-2)15(13)25-3)16-19-20-18-22(16)21-17(26-18)11-7-5-4-6-8-11/h9-11H,4-8H2,1-3H3
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| InChIKey |
ZZTWZBDVRVOFDA-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