COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580713
Chemical Name: methyl(Z)-3,3,3-trifluoro-2-{[(4-fluorophenyl)carbonyl]amino}-N-[6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]alaninate
Smiles: COC(=O)C(C(F)(F)F)(/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)NC(=O)c1ccc(cc1)F

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Molecular Weight: 505.47
Empirical Formula: C19H15F4N3O5S2

Physical State: Dry powder
Available Amount: 239 mg

Lipinsky:
logP: 6.931
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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