COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK668747
Chemical Name: 4-[(1E)-2-(acetylamino)-3-({4-[4-(2-{4-[4-({(2Z)-2-(acetylamino)-3-[4-(acetyloxy)phenyl]prop-2-enoyl}amino)phenoxy]phenyl}propan-2-yl)phenoxy]phenyl}amino)-3-oxoprop-1-en-1-yl]phenylacetate
Smiles: O=C(/C(=C/c1ccc(cc1)OC(=O)C)/NC(=O)C)Nc1ccc(cc1)Oc1ccc(cc1)C(c1ccc(cc1)Oc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)OC(=O)C)/NC(=O)C)(C)C

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Molecular Weight: 900.99
Empirical Formula: C53H48N4O10

Physical State: Dry powder
Available Amount: 33 mg

Lipinsky:
logP: 9.783
Rotatable bonds: 4
H-donors: 4
H-acceptors: 10
PSA: 187
Number of rings: 6

     

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