COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL279501
Chemical Name: N-(4-bromophenyl)-4-(4-ethoxyphenyl)-1-{[(4-methoxyphenyl)amino]methyl}-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCOc1ccc(cc1)c1c(C(=S)Nc2ccc(cc2)Br)n2c3c1CCCCn3c(n2)CNc1ccc(cc1)OC

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Molecular Weight: 630.61
Empirical Formula: C32H32BrN5O2S

Available Amount: 0 mg

Lipinsky:
logP: 7.019
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 96
Number of rings: 6

     

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