COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL454967
Chemical Name: 4-(acetyloxy)-13-({3-[(tert-butoxycarbonyl)amino]-2-hydroxy-3-phenylpropanoyl}oxy)-2,7-dihydroxy-9,10-dioxo-5,20-epoxytax-11-en-2-ylbenzoate
Smiles: CC(=O)OC12COC1CC(C1(C2C(O)(OC(=O)c2ccccc2)C2CC(OC(=O)C(C(c3ccccc3)NC(=O)OC(C)(C)C)O)C(=C(C2(C)C)C(=O)C1=O)C)C)O

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Molecular Weight: 805.88
Empirical Formula: C43H51NO14

Available Amount: 0 mg

Lipinsky:
logP: 7.146
Rotatable bonds: 13
H-donors: 4
H-acceptors: 14
PSA: 221
Number of rings: 6

     

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