General Information of the Compound
| Compound ID |
CP0853642
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| Compound Name |
SID89650082
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| Structure |
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| Formula |
C19H18N6O2S2
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| Molecular Weight |
426.527
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| Canonical SMILES |
Cn1nnnc1Sc1ncnc2scc(-c3ccc(C(=O)OC(C)(C)C)cc3)c12
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| InChI |
InChI=1S/C19H18N6O2S2/c1-19(2,3)27-17(26)12-7-5-11(6-8-12)13-9-28-15-14(13)16(21-10-20-15)29-18-22-23-24-25(18)4/h5-10H,1-4H3
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| InChIKey |
LHGZZJUBWUMICP-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