COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006753
Chemical Name: N-benzyl-4-(4-chlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: Clc1ccc(cc1)c1c(C(=S)NCc2ccccc2)n2c3c1CCCCn3c(n2)c1ccc(cc1)C

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Molecular Weight: 511.09
Empirical Formula: C30H27ClN4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.204
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 66
Number of rings: 6

     

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