COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK792250
Chemical Name: methyl3,3,3-trifluoro-N-[(3-methoxyphenyl)carbonyl]-2-{[6-(propan-2-yl)-1,3-benzothiazol-2-yl]amino}alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)OC)Nc1nc2c(s1)cc(cc2)C(C)C

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Molecular Weight: 481.5
Empirical Formula: C22H22F3N3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.761
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 117
Number of rings: 3

     

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