COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531205
Chemical Name: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2C)CCCCC3

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Molecular Weight: 549.49
Empirical Formula: C27H25BrN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.744
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 6

     

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