General Information of the Compound
| Compound ID |
CP0446583
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| Compound Name |
2-[4-[[(1S,2S)-2-pyrrolidin-1-yl-2,3-dihydro-1H-inden-1-yl]oxy]phenyl]-1,3-thiazole
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| Structure |
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| Formula |
C22H22N2OS
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| Molecular Weight |
362.498
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| Canonical SMILES |
C1CCN(C1)[C@H]1Cc2ccccc2[C@@H]1Oc1ccc(cc1)-c1nccs1
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| InChI |
InChI=1S/C22H22N2OS/c1-2-6-19-17(5-1)15-20(24-12-3-4-13-24)21(19)25-18-9-7-16(8-10-18)22-23-11-14-26-22/h1-2,5-11,14,20-21H,3-4,12-13,15H2/t20-,21-/m0/s1
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| InChIKey |
VZPLWXCOSBOCJY-SFTDATJTSA-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