COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552101
Chemical Name: 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-(4-methoxyphenyl)-N-[3-(4-methyl-1,3-thiazol-2-yl)benzyl]propanamide
Smiles: COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCc1cccc(c1)c1scc(n1)C

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Molecular Weight: 682.84
Empirical Formula: C39H42N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.414
Rotatable bonds: 8
H-donors: 3
H-acceptors: 7
PSA: 163
Number of rings: 5

     

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