General Information of the Compound
| Compound ID |
CP0529546
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| Compound Name |
(3R)-3-methyl-4-[5-(morpholin-4-ylmethyl)-2-(1H-pyrazol-5-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
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| Structure |
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| Formula |
C18H23N7O2S
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| Molecular Weight |
401.496
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| Canonical SMILES |
C[C@@H]1COCCN1c1nc(CN2CCOCC2)nc2sc(nc12)-c1cc[nH]n1
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| InChI |
InChI=1S/C18H23N7O2S/c1-12-11-27-9-6-25(12)16-15-18(28-17(22-15)13-2-3-19-23-13)21-14(20-16)10-24-4-7-26-8-5-24/h2-3,12H,4-11H2,1H3,(H,19,23)/t12-/m1/s1
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| InChIKey |
OYHVYLGBSUCUGR-GFCCVEGCSA-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