COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL264332
Chemical Name: 1-(4-bromophenyl)-N-(2,5-dimethylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Brc1ccc(cc1)c1c(C(=S)Nc2cc(C)ccc2C)n2c3c1CCCCn3c(c2)c1ccccc1

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Molecular Weight: 554.55
Empirical Formula: C31H28BrN3S

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 9.11
Rotatable bonds: 1
H-donors: 1
H-acceptors: 0
PSA: 53
Number of rings: 6

     

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