COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079497
Chemical Name: 1-[(4-methoxyphenyl)amino]-4-(prop-2-en-1-yl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCn1c2nnc(n2c2c(c1=O)c1CCCCc1s2)Nc1ccc(cc1)OC

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Molecular Weight: 407.5
Empirical Formula: C21H21N5O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.031
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 5

     

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