COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110776
Chemical Name: 4-{[4-(diethylamino)benzylidene]amino}-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)c1nnc(n1/N=C\c1ccc(cc1)N(CC)CC)S

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Molecular Weight: 381.5
Empirical Formula: C20H23N5OS

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 6.231
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 94
Number of rings: 3

     

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