COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631777
Chemical Name: 2-(2-{3-[5-(2-methylpropyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)CCN1C(=O)c2c(C1=O)cccc2)C

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Molecular Weight: 421.48
Empirical Formula: C20H19N7O2S

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 4.129
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 137
Number of rings: 5

     

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