General Information of the Compound
| Compound ID |
CP0524402
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| Compound Name |
3-[1-(2-Bromo-phenyl)-meth-(E)-ylidene]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-(9Z)-ylidene-cyanamide
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| Formula |
C19H13BrN4
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| Molecular Weight |
377.245
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| Canonical SMILES |
Brc1ccccc1\C=C1/CCn2c1nc1ccccc1\c2=N\C#N
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| InChI |
InChI=1S/C19H13BrN4/c20-16-7-3-1-5-13(16)11-14-9-10-24-18(14)23-17-8-4-2-6-15(17)19(24)22-12-21/h1-8,11H,9-10H2/b14-11+,22-19-
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| InChIKey |
RRAIFXCPCLLRNH-ZDFGYQKHSA-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