COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL271839
Chemical Name: 1-(4-bromophenyl)-4-phenyl-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2H-2,3,8b-triazacyclopenta[cd]azulene-2-carbothioamide
Smiles: C=CCNC(=S)n1c2nc(c3n2c(c1c1ccc(cc1)Br)CCCC3)c1ccccc1

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Molecular Weight: 491.45
Empirical Formula: C25H23BrN4S

Available Amount: 0 mg

Lipinsky:
logP: 7.98
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 66
Number of rings: 5

     

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