COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192281
Chemical Name: (2E)-1-{3,5-bis[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}-3-(4-methoxyphenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)n1nc(nc1NCc1cccs1)NCc1cccs1

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Molecular Weight: 451.57
Empirical Formula: C22H21N5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.488
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 137
Number of rings: 4

     

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