COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049326
Chemical Name: (5Z)-5-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methylidene)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(CCN2C(=O)N=C(/C(=C/NCCC3=CCCCC3)/C2=O)O)ccc1OC

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Molecular Weight: 427.5
Empirical Formula: C23H29N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.317
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 3

     

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