COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK960023
Chemical Name: methyl2-[({5-[(4-bromo-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2ccc(o2)Cn2ncc(c2)Br)sc2c1CCCCC2

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Molecular Weight: 478.37
Empirical Formula: C20H20BrN3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.721
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 4

     

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