COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK682057
Chemical Name: N-[(1Z)-1-(1,3-benzodioxol-5-yl)-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-3-bromobenzamide
Smiles: Brc1cccc(c1)C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)NCCc1c(C)[nH]c2c1cccc2

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Molecular Weight: 546.42
Empirical Formula: C28H24BrN3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.256
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 92
Number of rings: 5

     

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