COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526439
Chemical Name: (8xi,14xi,17xi,19E)-19-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)imino]-3,5,14-trihydroxycard-20(22)-enolide
Smiles: O=C1OCC(=C1)C1CCC2([C@]1(C)CC[C@H]1C2CCC2([C@@]1(CCC(C2)O)/C=N/C1CCOC(C1)(C)C)O)O

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Molecular Weight: 515.69
Empirical Formula: C30H45NO6

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 1.676
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 108
Number of rings: 6

     

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