COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687542
Chemical Name: N-benzyl-1-[(4-chlorophenoxy)methyl]-4-(3,4-dichlorophenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: Clc1ccc(cc1)OCc1nn2c3n1CCCCc3c(c2C(=S)NCc1ccccc1)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 595.98
Empirical Formula: C30H25Cl3N4OS

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 8.298
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 75
Number of rings: 6

     

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