General Information of the Compound
| Compound ID |
CP0388125
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| Compound Name |
CHEMBL1223807
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| Formula |
C21H30N2O3
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| Molecular Weight |
358.482
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| Canonical SMILES |
CCO[C@H]1CC[C@@](C)(CC1)N1CCC(CC1)n1c2ccccc2oc1=O
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| InChI |
InChI=1S/C21H30N2O3/c1-3-25-17-8-12-21(2,13-9-17)22-14-10-16(11-15-22)23-18-6-4-5-7-19(18)26-20(23)24/h4-7,16-17H,3,8-15H2,1-2H3/t17-,21-
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| InChIKey |
CGXQSGGPBGLGOJ-CYWCHRQTSA-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