General Information of the Compound
| Compound ID |
CP0335639
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| Compound Name |
2-[(5R)-2-(4-hydroxyphenyl)-5H-chromeno[2,3-b]pyridin-5-yl]-2-methyl-N-(1,3,4-thiadiazol-2-yl)propanamide
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| Structure |
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| Formula |
C24H20N4O3S
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| Molecular Weight |
444.516
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| Canonical SMILES |
CC(C)([C@@H]1c2ccccc2Oc2nc(ccc12)-c1ccc(O)cc1)C(=O)Nc1nncs1
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| InChI |
InChI=1S/C24H20N4O3S/c1-24(2,22(30)27-23-28-25-13-32-23)20-16-5-3-4-6-19(16)31-21-17(20)11-12-18(26-21)14-7-9-15(29)10-8-14/h3-13,20,29H,1-2H3,(H,27,28,30)/t20-/m1/s1
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| InChIKey |
ZAJFFJDEVBHMIF-HXUWFJFHSA-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
Protein ID: PT00967, Glucocorticoid receptor