COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK763522
Chemical Name: methylN-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-[(methoxycarbonyl)amino]alaninate
Smiles: COC(=O)NC(C(F)(F)F)(C(=O)OC)Nc1sc2c(c1C#N)CCCC2

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Molecular Weight: 391.37
Empirical Formula: C15H16F3N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.414
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 128
Number of rings: 2

     

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