COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994520
Chemical Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Smiles: CCCCc1nnc(s1)NC(=O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

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Molecular Weight: 452.65
Empirical Formula: C18H20N4O2S4

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 3.377
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 189
Number of rings: 3

     

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