COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK721937
Chemical Name: 8-(butoxymethyl)-3-({[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3-methyl-2,7-dioxaspiro[4.4]nonane-1,6-dione
Smiles: CCCCOCC1OC(=O)C2(C1)CC(OC2=O)(C)C(=O)CSc1nnc([nH]1)c1ccccc1Cl

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Molecular Weight: 507.99
Empirical Formula: C23H26ClN3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.218
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 145
Number of rings: 4

     

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