COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631507
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-[3-(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)propyl]prop-2-enamide
Smiles: O=C(/C=C/c1ccc2c(c1)OCO2)NCCCc1nnc2n1c(C)cc(n2)C

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Molecular Weight: 379.42
Empirical Formula: C20H21N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.371
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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