COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL266796
Chemical Name: 4-(4-bromophenyl)-N-(4-chlorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Clc1ccc(cc1)NC(=S)c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(cc1)Br

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Molecular Weight: 560.94
Empirical Formula: C29H23BrClN3S

Available Amount: 0 mg

Lipinsky:
logP: 9.179
Rotatable bonds: 1
H-donors: 1
H-acceptors: 0
PSA: 53
Number of rings: 6

     

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