COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048761
Chemical Name: (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(CCN2C(=O)N=C(/C(=C/NCCCn3cncc3)/C2=O)O)ccc1OC

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Molecular Weight: 427.46
Empirical Formula: C21H25N5O5

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 0.494
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 118
Number of rings: 3

     

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