COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK936774
Chemical Name: 3-methyl-5-oxo-5-[(2E)-1,3,4-thiadiazol-2(3H)-ylideneamino]pentanoicacid
Smiles: CC(CC(=O)O)CC(=O)/N=c\1/scn[nH]1

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Molecular Weight: 229.26
Empirical Formula: C8H11N3O3S

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: -0.177
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 1

     

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