COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL025224
Chemical Name: N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)CCNC(=O)/C(=C/c1cn(c2c1cccc2)C)/NC(=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 543.62
Empirical Formula: C31H33N3O6

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.074
Rotatable bonds: 10
H-donors: 2
H-acceptors: 6
PSA: 100
Number of rings: 4

     

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