General Information of the Compound
| Compound ID |
CP0921896
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| Compound Name |
2-(4-tert-Butyl-phenyl)-6-isopropyl-3,4-dihydro-2H-quinoline-1-carboxamidine hydrochloride
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| Structure |
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| Formula |
C23H32ClN3
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| Molecular Weight |
385.983
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| Canonical SMILES |
CC(C)c1ccc2c(c1)CCC(c1ccc(C(C)(C)C)cc1)N2C(=N)N.Cl
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| InChI |
InChI=1S/C23H31N3.ClH/c1-15(2)17-8-12-21-18(14-17)9-13-20(26(21)22(24)25)16-6-10-19(11-7-16)23(3,4)5;/h6-8,10-12,14-15,20H,9,13H2,1-5H3,(H3,24,25);1H
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| InChIKey |
YZXWWIJPLMZMQH-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