COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307275
Chemical Name: 5-{4-[(4-chloro-3,5-dimethylphenoxy)methyl]phenyl}-4-[3-(diethylamino)propyl]-4H-1,2,4-triazole-3-thiol
Smiles: CCN(CCCn1c(S)nnc1c1ccc(cc1)COc1cc(C)c(c(c1)C)Cl)CC

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Molecular Weight: 459.06
Empirical Formula: C24H31ClN4OS

Physical State: Dry powder
Available Amount: 29 mg

Lipinsky:
logP: 7.352
Rotatable bonds: 7
H-donors: 0
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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