General Information of the Compound
| Compound ID |
CP0485022
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| Compound Name |
3-[1-(4-Methoxy-phenyl)-meth-(E)-ylidene]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-(9Z)-ylideneamine
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| Structure |
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| Formula |
C19H17N3O
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| Molecular Weight |
303.365
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| Canonical SMILES |
COc1ccc(\C=C2/CCn3c2nc2ccccc2c3=N)cc1
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| InChI |
InChI=1S/C19H17N3O/c1-23-15-8-6-13(7-9-15)12-14-10-11-22-18(20)16-4-2-3-5-17(16)21-19(14)22/h2-9,12,20H,10-11H2,1H3/b14-12+,20-18?
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| InChIKey |
PZDOLKPETURVGH-BRXGSZSSSA-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