COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK204181
Chemical Name: methyl3-({5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}carbamoyl)-5-nitrobenzoate
Smiles: COCCSc1nnc(s1)NC(=O)c1cc(cc(c1)C(=O)OC)[N+](=O)[O-]

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Molecular Weight: 398.42
Empirical Formula: C14H14N4O6S2

Physical State: Dry powder
Available Amount: 437 mg

Lipinsky:
logP: 2.641
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 189
Number of rings: 2

     

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