COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL558604
Chemical Name: N-[(1Z)-3-{[2-(1H-indol-3-yl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)N/C(=C\c1cn(c2c1cccc2)C)/C(=O)NCCc1c[nH]c2c1cccc2

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Molecular Weight: 522.6
Empirical Formula: C31H30N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.261
Rotatable bonds: 8
H-donors: 3
H-acceptors: 4
PSA: 97
Number of rings: 5

     

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