COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK286055
Chemical Name: 3-{[(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)acetyl]amino}-4-methylbenzoicacid(non-preferredname)
Smiles: O=C(Nc1cc(ccc1C)C(=O)O)CN1C(=O)C2C(C1=O)C1(Br)c3c(C2c2c1cccc2)cccc3

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Molecular Weight: 545.39
Empirical Formula: C28H21BrN2O5

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 5.114
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 103
Number of rings: 7

     

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