COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK625766
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(9H-purin-6-yl)piperidine-4-carboxamide
Smiles: COc1cc(CCNC(=O)C2CCN(CC2)c2ncnc3c2nc[nH]3)ccc1OC

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Molecular Weight: 410.48
Empirical Formula: C21H26N6O3

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 1.993
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 4

     

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