General Information of the Compound
| Compound ID |
CP0049939
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| Compound Name |
(Z)-2-(1,3-benzothiazol-2-yl)-3-(2-furanyl)-2-propenenitrile
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| Structure |
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| Formula |
C14H8N2OS
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| Molecular Weight |
252.298
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| Canonical SMILES |
N#C\C(=C\c1ccco1)c1nc2ccccc2s1
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| InChI |
InChI=1S/C14H8N2OS/c15-9-10(8-11-4-3-7-17-11)14-16-12-5-1-2-6-13(12)18-14/h1-8H/b10-8-
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| InChIKey |
DBIXCVADFDLNNY-NTMALXAHSA-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