COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK775526
Chemical Name: N-[5-(4-methoxybenzyl)-1,3,4-thiadiazol-2-yl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide
Smiles: COc1ccc(cc1)Cc1nnc(s1)NC(=O)CCCn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 402.43
Empirical Formula: C17H18N6O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.231
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 155
Number of rings: 3

     

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