COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455965
Chemical Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(piperidin-1-ylcarbonyl)phenyl]thiourea
Smiles: COc1cc(CCNC(=S)Nc2ccc(cc2)C(=O)N2CCCCC2)ccc1OC

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Molecular Weight: 427.57
Empirical Formula: C23H29N3O3S

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 2.471
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 94
Number of rings: 3

     

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