COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK268722
Chemical Name: 2-(4-nitrophenyl)-2-oxoethyl2-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate(non-preferredname)
Smiles: O=C(c1ccccc1N1C(=O)C2C(C1=O)C1(Br)c3c(C2c2c1cccc2)cccc3)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 637.44
Empirical Formula: C33H21BrN2O7

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 5.562
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 126
Number of rings: 7

     

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