COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547875
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-L-methioninamide
Smiles: CSCC[C@@H](C(=O)Nc1scc(n1)c1ccc2c(c1)OCO2)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 718.85
Empirical Formula: C36H38N4O8S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.665
Rotatable bonds: 8
H-donors: 3
H-acceptors: 8
PSA: 199
Number of rings: 6

     

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