COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK751899
Chemical Name: 1-(5,5-dimethyl-3-{[(4E)-1-oxido-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxy-3-methylurea
Smiles: CNC(=O)N(C1N(/N=C/2\CCCc3c2no[n+]3[O-])C(=S)SC1(C)C)O

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Molecular Weight: 386.46
Empirical Formula: C13H18N6O4S2

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: -0.83
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 177
Number of rings: 3

     

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