COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK450284
Chemical Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea
Smiles: CCOc1cc(CCNC(=S)Nc2ccc(cc2OC)[N+](=O)[O-])ccc1OCC

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Molecular Weight: 419.5
Empirical Formula: C20H25N3O5S

Physical State: Dry powder
Available Amount: 541 mg

Lipinsky:
logP: 4.54
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 129
Number of rings: 2

     

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