COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401952
Chemical Name: N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Smiles: COc1nn(cc1[N+](=O)[O-])CCc1nnc(s1)Nc1ccn(n1)Cc1c(F)cccc1Cl

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Molecular Weight: 478.89
Empirical Formula: C18H16ClFN8O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.232
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 156
Number of rings: 4

     

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