COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL402456
Chemical Name: N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-[1-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]-1,3,4-thiadiazol-2-amine
Smiles: CC(c1nnc(s1)Nc1ccn(n1)Cc1ccccc1Cl)Cn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 444.9
Empirical Formula: C18H17ClN8O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.887
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 147
Number of rings: 4

     

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