COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK728620
Chemical Name: methyl4-[1-(1H-indol-3-yl)-2-nitroethyl]benzoate
Smiles: COC(=O)c1ccc(cc1)C(c1c[nH]c2c1cccc2)C[N+](=O)[O-]

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Molecular Weight: 324.34
Empirical Formula: C18H16N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.677
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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