General Information of the Compound
| Compound ID |
CP0918694
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| Compound Name |
(2S,6R)-4-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-1,7-dimethyl-10-oxa-4-azatricyclo[5.2.1.0^{2,6}]decane-3,5-dione
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| Structure |
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| Formula |
C20H20N2O5
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| Molecular Weight |
368.389
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| Canonical SMILES |
COc1cc(N2C(=O)[C@@H]3[C@H](C2=O)C2(C)CCC3(C)O2)ccc1-c1cnco1
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| InChI |
InChI=1S/C20H20N2O5/c1-19-6-7-20(2,27-19)16-15(19)17(23)22(18(16)24)11-4-5-12(13(8-11)25-3)14-9-21-10-26-14/h4-5,8-10,15-16H,6-7H2,1-3H3/t15-,16+,19?,20?
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| InChIKey |
YAEJSSQGTYFDJH-BANKROOTSA-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