COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK420513
Chemical Name: methyl2-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorononanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCC2)NC(=O)C(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

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Molecular Weight: 653.38
Empirical Formula: C20H15F16NO3S

Physical State: Dry powder
Available Amount: 2421 mg

Lipinsky:
logP: 10.735
Rotatable bonds: 10
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 2

     

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