COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK181798
Chemical Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(3-methoxyphenyl)-1H-indol-3-yl]-2,3-dihydro-1H-isoindol-1-one
Smiles: COc1cccc(c1)c1[nH]c2c(c1C1N(Cc3ccc4c(c3)OCO4)C(=O)c3c1cccc3)cccc2

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Molecular Weight: 488.54
Empirical Formula: C31H24N2O4

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 5.442
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 7

     

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