General Information of the Compound
| Compound ID |
CP0858937
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| Compound Name |
endo-1-(3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2,2-diphenylpropyl)urea
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| Formula |
C24H31N3O
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| Molecular Weight |
377.532
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| Canonical SMILES |
CN1[C@@H]2CC[C@H]1C[C@@H](CC(CNC(N)=O)(c1ccccc1)c1ccccc1)C2
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| InChI |
InChI=1S/C24H31N3O/c1-27-21-12-13-22(27)15-18(14-21)16-24(17-26-23(25)28,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,18,21-22H,12-17H2,1H3,(H3,25,26,28)/t18-,21+,22-
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| InChIKey |
XVTZQTLXSLKPCP-FJPGZJACSA-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