COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL271624
Chemical Name: N-(4-bromophenyl)-4-{[(4-bromophenyl)amino]methyl}-1-phenyl-5,6,7,8-tetrahydro-2H-2,3,8b-triazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Brc1ccc(cc1)NCc1nc2n3c1CCCCc3c(n2C(=S)Nc1ccc(cc1)Br)c1ccccc1

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Molecular Weight: 635.43
Empirical Formula: C29H25Br2N5S

Available Amount: 0 mg

Lipinsky:
logP: 9.195
Rotatable bonds: 2
H-donors: 2
H-acceptors: 0
PSA: 78
Number of rings: 6

     

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