COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK680386
Chemical Name: 4-(4-bromophenyl)-1-(4-methoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: COc1ccc(cc1)c1nn2c3n1CCCCc3c(c2C(=S)Nc1ccccc1)c1ccc(cc1)Br

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Molecular Weight: 557.51
Empirical Formula: C29H25BrN4OS

Available Amount: 0 mg

Lipinsky:
logP: 7.872
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 75
Number of rings: 6

     

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