COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547740
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-L-methioninamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 675.81
Empirical Formula: C35H41N5O7S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 2.61
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 163
Number of rings: 5

     

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