COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK291863
Chemical Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,2-dimethyl-1H-indol-3-yl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Smiles: COc1cc(CCN2C(=O)C3=C(C2c2c(C)n(c4c2cccc4)C)CCCC3)ccc1OC

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Molecular Weight: 444.57
Empirical Formula: C28H32N2O3

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 5.201
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 43
Number of rings: 5

     

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