COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK306432
Chemical Name: ethyl5-({[3-(3-chloro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)Cl

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Molecular Weight: 473.98
Empirical Formula: C22H24ClN5O3S

Physical State: Dry powder
Available Amount: 25 mg

Lipinsky:
logP: 4.104
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 138
Number of rings: 6

     

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