COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK691711
Chemical Name: N-({5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-2-(3,4-dimethoxyphenyl)ethanamine
Smiles: COc1cc(CCNCC2=NOC(C2)Cc2cc(OC)c3c(c2OC)OCO3)ccc1OC

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Saltdata: 0,5 HOOCCOOH
Molecular Weight: 458.51
Empirical Formula: C24H30N2O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.709
Rotatable bonds: 11
H-donors: 1
H-acceptors: 7
PSA: 89
Number of rings: 4

     

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