COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK049723
Chemical Name: (2E)-N-[5-({2-[(2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Smiles: O=C(Nc1nnc(s1)SCC(=O)Nc1ccccc1[N+](=O)[O-])/C=C/c1ccccc1

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Molecular Weight: 441.49
Empirical Formula: C19H15N5O4S2

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 4.478
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 183
Number of rings: 3

     

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