COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK569607
Chemical Name: 1-(2,4-dichlorophenyl)-4-(4-ethoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCOc1ccc(cc1)c1c(C(=S)Nc2ccccc2)n2c3c1CCCCn3c(n2)c1ccc(cc1Cl)Cl

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Molecular Weight: 561.53
Empirical Formula: C30H26Cl2N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.097
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 75
Number of rings: 6

     

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