General Information of the Compound
| Compound ID |
CP0326837
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| Compound Name |
US9090625, 2
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| Structure |
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| Formula |
C17H14N4S
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| Molecular Weight |
306.394
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| Canonical SMILES |
Cc1cc(-c2cc3cnccc3s2)n(n1)-c1cccc(C)n1
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| InChI |
InChI=1S/C17H14N4S/c1-11-4-3-5-17(19-11)21-14(8-12(2)20-21)16-9-13-10-18-7-6-15(13)22-16/h3-10H,1-2H3
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| InChIKey |
JNXNNFRGVXEOSW-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