General Information of the Compound
| Compound ID |
CP0433352
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| Compound Name |
3-(diethylamino)propyl (3S)-3-methyl-2-phenylpentanoate
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| Structure |
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| Formula |
C19H31NO2
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| Molecular Weight |
305.462
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| Canonical SMILES |
CC[C@H](C)C(C(=O)OCCCN(CC)CC)c1ccccc1
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| InChI |
InChI=1S/C19H31NO2/c1-5-16(4)18(17-12-9-8-10-13-17)19(21)22-15-11-14-20(6-2)7-3/h8-10,12-13,16,18H,5-7,11,14-15H2,1-4H3/t16-,18?/m0/s1
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| InChIKey |
YHOBTARVXRPKOX-ATNAJCNCSA-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