COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511586
Chemical Name: N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]glycinamide
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NCC(=O)Nc2nc3c(s2)cc(cc3)OC(F)(F)F)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 658.66
Empirical Formula: C31H29F3N4O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.68
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 165
Number of rings: 5

     

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