COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL454988
Chemical Name: N-[3-({4,10-bis(acetyloxy)-1,7-dihydroxy-9-oxo-2-[(phenylcarbonyl)oxy]-5,20-epoxytax-11-en-13-yl}oxy)-2-hydroxy-3-oxo-1-phenylpropyl]benzenecarboximidicacid
Smiles: CC(=O)OC1C(=O)C2(C)C(O)CC3C(C2C(C2(C(C1=C(C)C(OC(=O)C(C(c1ccccc1)/N=C(/c1ccccc1)\O)O)C2)(C)C)O)OC(=O)c1ccccc1)(CO3)OC(=O)C

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Molecular Weight: 853.92
Empirical Formula: C47H51NO14

Available Amount: 0 mg

Lipinsky:
logP: 7.733
Rotatable bonds: 15
H-donors: 4
H-acceptors: 14
PSA: 224
Number of rings: 7

     

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