COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK074867
Chemical Name: 2-({5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: O=C(N1CCN(CC1)c1ccccc1)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C1CCCCC1

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Molecular Weight: 567.76
Empirical Formula: C33H37N5O2S

Physical State: Dry powder
Available Amount: 217 mg

Lipinsky:
logP: 7.853
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 6

     

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