COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527486
Chemical Name: (8xi,14xi,17alpha,19E)-19-{[2-(4-fluorophenyl)ethyl]imino}-3,5,14-trihydroxycard-20(22)-enolide
Smiles: OC1CC[C@]2(C(C1)(O)CCC1[C@@H]2CC[C@]2(C1(O)CC[C@H]2C1=CC(=O)OC1)C)/C=N/CCc1ccc(cc1)F

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Molecular Weight: 525.66
Empirical Formula: C31H40FNO5

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.726
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 99
Number of rings: 6

     

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