COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK694021
Chemical Name: (3Z)-4-(3,4-dimethoxyphenyl)-4-hydroxybuta-1,3-diene-1,1,2-tricarbonitrile
Smiles: N#CC(=C(C#N)C#N)/C=C(/c1ccc(c(c1)OC)OC)\O

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Saltdata: HN(CH2CH2)2NH
Molecular Weight: 281.27
Empirical Formula: C15H11N3O3

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 0.973
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 110
Number of rings: 1

     

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