COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK763200
Chemical Name: ethylN-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3,3,3-trifluoro-2-({[3-(trifluoromethyl)phenyl]carbonyl}amino)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCCC2)NC(=O)c1cccc(c1)C(F)(F)F

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Molecular Weight: 533.49
Empirical Formula: C23H21F6N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.397
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 3

     

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