COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK108955
Chemical Name: 4-{[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]amino}-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)c1nnc(n1/N=C\C(=C\c1ccccc1)\Br)S

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Molecular Weight: 415.31
Empirical Formula: C18H15BrN4OS

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 6.296
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 91
Number of rings: 3

     

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