General Information of the Compound
| Compound ID |
CP0379156
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| Compound Name |
N,N'-di(quinolin-4-yl)ethane-1,2-diamine
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| Structure |
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| Formula |
C20H18N4
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| Molecular Weight |
314.392
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| Canonical SMILES |
C(CNc1ccnc2ccccc12)Nc1ccnc2ccccc12
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| InChI |
InChI=1S/C20H18N4/c1-3-7-17-15(5-1)19(9-11-21-17)23-13-14-24-20-10-12-22-18-8-4-2-6-16(18)20/h1-12H,13-14H2,(H,21,23)(H,22,24)
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| InChIKey |
FGYOUZJTBKNABF-UHFFFAOYSA-N
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| CAS |
96573-47-6
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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
Protein ID: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01089, Alpha-1A adrenergic receptor
Protein ID: PT01007, Alpha-1B adrenergic receptor
Protein ID: PT01004, Alpha-1D adrenergic receptor