General Information of the Compound
| Compound ID |
CP0505786
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| Compound Name |
N,N-dimethyl-2-[3-(pyridin-4-ylmethyl)-1H-inden-2-yl]ethanamine
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| Structure |
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| Formula |
C19H22N2
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| Molecular Weight |
278.399
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| Canonical SMILES |
CN(C)CCC1=C(Cc2ccncc2)c2ccccc2C1
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| InChI |
InChI=1S/C19H22N2/c1-21(2)12-9-17-14-16-5-3-4-6-18(16)19(17)13-15-7-10-20-11-8-15/h3-8,10-11H,9,12-14H2,1-2H3
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| InChIKey |
QLIVKGYZYOUCNK-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
Protein ID: PT01310, Muscarinic acetylcholine receptor M1
Protein ID: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3
Protein ID: PT01156, Muscarinic acetylcholine receptor M4
Protein ID: PT01516, Muscarinic acetylcholine receptor M5