COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551930
Chemical Name: N~3~-{3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]-3-(3,4,5-trimethoxyphenyl)propanoyl}-N-1,3-thiazol-2-yl-beta-alaninamide
Smiles: COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCC(=O)Nc1nccs1

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Molecular Weight: 709.82
Empirical Formula: C36H43N3O10S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.517
Rotatable bonds: 10
H-donors: 4
H-acceptors: 10
PSA: 210
Number of rings: 4

     

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