COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056118
Chemical Name: butyl[(2E)-5-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
Smiles: CCCCOC(=O)/N=c/1\[nH]nc(s1)/C=C/c1ccc(cc1)OC

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Molecular Weight: 333.41
Empirical Formula: C16H19N3O3S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 4.067
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 2

     

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