COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712863
Chemical Name: 2-butyl-7-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: CCCCc1sc2n(n1)c(=O)cc(n2)N1CCN(CC1)c1c(Cl)cccc1[N+](=O)[O-]

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Molecular Weight: 448.93
Empirical Formula: C19H21ClN6O3S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.276
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 122
Number of rings: 4

     

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