General Information of the Compound
| Compound ID |
CP0456355
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| Compound Name |
(R)-quinuclidin-3-yl phenyl(thiophen-3-ylmethyl)carbamate
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| Structure |
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| Formula |
C19H22N2O2S
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| Molecular Weight |
342.464
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| Canonical SMILES |
O=C(O[C@H]1CN2CCC1CC2)N(Cc1ccsc1)c1ccccc1
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| InChI |
InChI=1S/C19H22N2O2S/c22-19(23-18-13-20-9-6-16(18)7-10-20)21(12-15-8-11-24-14-15)17-4-2-1-3-5-17/h1-5,8,11,14,16,18H,6-7,9-10,12-13H2/t18-/m0/s1
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| InChIKey |
JZXJMFOSRNVGHQ-SFHVURJKSA-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