COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK680715
Chemical Name: 1-[(4-bromophenoxy)methyl]-4-(4-ethoxyphenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1cccc(c1)C)nc3COc1ccc(cc1)Br

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Molecular Weight: 615.59
Empirical Formula: C32H31BrN4O2S

Available Amount: 0 mg

Lipinsky:
logP: 8.067
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 6

     

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