General Information of the Compound
| Compound ID |
CP0355965
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| Compound Name |
3-[7-[(3R)-3-methylmorpholin-4-yl]-5-[(3S)-3-methylmorpholin-4-yl]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]phenol
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| Structure |
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| Formula |
C21H25N5O3S
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| Molecular Weight |
427.53
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| Canonical SMILES |
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cccc(O)c1
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| InChI |
InChI=1S/C21H25N5O3S/c1-13-11-28-8-6-25(13)18-17-20(24-21(23-18)26-7-9-29-12-14(26)2)30-19(22-17)15-4-3-5-16(27)10-15/h3-5,10,13-14,27H,6-9,11-12H2,1-2H3/t13-,14+/m1/s1
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| InChIKey |
LMQLLTCGLMHNRO-KGLIPLIRSA-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