COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712861
Chemical Name: 7-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)c1cc(=O)n2c(n1)sc(n2)C(C)C

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Molecular Weight: 434.91
Empirical Formula: C18H19ClN6O3S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.336
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 122
Number of rings: 4

     

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