COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL386884
Chemical Name: N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Smiles: Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 458.93
Empirical Formula: C19H19ClN8O2S

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 3.46
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 147
Number of rings: 4

     

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