COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380645
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2,2-dimethyl-4-(4-methylphenyl)tetrahydro-2H-pyran-4-yl]ethanamine
Smiles: Cc1ccc(cc1)C1(CCNCc2ccc3c(c2)OCO3)CCOC(C1)(C)C

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Saltdata: HCl
Molecular Weight: 381.52
Empirical Formula: C24H31NO3

Physical State: Dry powder
Available Amount: 526 mg

Lipinsky:
logP: 5.187
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 39
Number of rings: 4

     

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