General Information of the Compound
| Compound ID |
CP0374462
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| Compound Name |
3-[1-(2-Ethyl-phenyl)-meth-(E)-ylidene]-1,2,3,9-tetrahydro-pyrrolo[2,1-b]quinazoline
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| Structure |
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| Formula |
C20H20N2
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| Molecular Weight |
288.394
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| Canonical SMILES |
CCc1ccccc1\C=C1/CCN2Cc3ccccc3N=C12
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| InChI |
InChI=1S/C20H20N2/c1-2-15-7-3-4-8-16(15)13-17-11-12-22-14-18-9-5-6-10-19(18)21-20(17)22/h3-10,13H,2,11-12,14H2,1H3/b17-13+
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| InChIKey |
VTPUDRXEVWKQNO-GHRIWEEISA-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