General Information of the Compound
| Compound ID |
CP0375815
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| Compound Name |
N,N-dimethyl-2-(pyridin-2-ylmethyl)-3-spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-1'-ylpropanamide
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| Structure |
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| Formula |
C22H29N3O2S
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| Molecular Weight |
399.56
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| Canonical SMILES |
CN(C)C(=O)C(CN1CCC2(CC1)OCCc1ccsc21)Cc1ccccn1
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| InChI |
InChI=1S/C22H29N3O2S/c1-24(2)21(26)18(15-19-5-3-4-10-23-19)16-25-11-8-22(9-12-25)20-17(6-13-27-22)7-14-28-20/h3-5,7,10,14,18H,6,8-9,11-13,15-16H2,1-2H3
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| InChIKey |
FCFFIEPLNCDDSF-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