COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527674
Chemical Name: methyl2-{[(4-chlorophenyl)carbonyl]amino}-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3,3,3-trifluoroalaninate
Smiles: N#Cc1c(sc2c1CCCCC2)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1)Cl

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Molecular Weight: 485.91
Empirical Formula: C21H19ClF3N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.574
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 3

     

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