COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022682
Chemical Name: (2E)-N-[5-({2-[(4-methoxy-2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Smiles: COc1ccc(c(c1)[N+](=O)[O-])NC(=O)CSc1nnc(s1)NC(=O)/C=C/c1ccccc1

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Molecular Weight: 471.52
Empirical Formula: C20H17N5O5S2

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.794
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 192
Number of rings: 3

     

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