COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562006
Chemical Name: 3-(1,3-benzodioxol-5-yl)-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-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl
Smiles: O=C1CCC/C=C/c2cc(O)c(c(c2C(=O)O[C@H](CCC1)C)O)C(c1ccc2c(c1)OCO2)CC(=O)NCc1cc(=O)n(c(=O)n1C)C

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Molecular Weight: 661.71
Empirical Formula: C35H39N3O10

Available Amount: 0 mg

Lipinsky:
logP: 4.835
Rotatable bonds: 8
H-donors: 3
H-acceptors: 10
PSA: 172
Number of rings: 5

     

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