COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550244
Chemical Name: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(3,4,5-trimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 437.48
Empirical Formula: C22H19N3O5S

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 4.375
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 123
Number of rings: 4

     

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