COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551731
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]-N-{[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl](phenyl)methyl}-3-(3,4,5-trimethoxyphenyl)propa
Smiles: COCc1n[nH]c(n1)C(c1ccccc1)NC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 756.85
Empirical Formula: C41H48N4O10

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.945
Rotatable bonds: 11
H-donors: 4
H-acceptors: 10
PSA: 191
Number of rings: 5

     

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