COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL266860
Chemical Name: N-(4-chlorophenyl)-4-(4-fluorophenyl)-1-{[(4-fluorophenyl)amino]methyl}-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: Fc1ccc(cc1)c1c(C(=S)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(n2)CNc1ccc(cc1)F

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Molecular Weight: 548.06
Empirical Formula: C29H24ClF2N5S

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 7.061
Rotatable bonds: 3
H-donors: 2
H-acceptors: 0
PSA: 78
Number of rings: 6

     

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