COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK728500
Chemical Name: {4-[(1E)-3-amino-2-cyano-3-thioxoprop-1-en-1-yl]phenoxy}aceticacid
Smiles: N#C/C(=C\c1ccc(cc1)OCC(=O)O)/C(=S)N

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Molecular Weight: 262.29
Empirical Formula: C12H10N2O3S

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 1.075
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 128
Number of rings: 1

     

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