COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL154743
Chemical Name: 3-[4-(2-{[3-(morpholin-4-yl)propyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperazin-1-yl]propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=C(C(=O)C1=O)NCCCN1CCOCC1

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Molecular Weight: 361.44
Empirical Formula: C18H27N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -1.372
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 88
Number of rings: 3

     

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