COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK975578
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2-methoxyphenyl)-2,2-dimethyltetrahydro-2H-pyran-4-yl]ethanamine
Smiles: COc1ccccc1C1(CCNCc2ccc3c(c2)OCO3)CCOC(C1)(C)C

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Saltdata: C2H2O4
Molecular Weight: 397.51
Empirical Formula: C24H31NO4

Physical State: Liquid
Available Amount: 300 mg

Lipinsky:
logP: 4.642
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 48
Number of rings: 4

     

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