COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL522447
Chemical Name: 1-(2-{6-[(E)-(hydroxyimino)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1-methyl-3-(2-phenylethyl)thiourea
Smiles: O/N=C/c1c(CCN(C(=S)NCCc2ccccc2)C)cc2c(c1OC)OCO2

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Molecular Weight: 415.51
Empirical Formula: C21H25N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.12
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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