COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534100
Chemical Name: 1-(3-((((3S,3aR,8aR,9aR)-8a-methyl-2-oxodecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-3-yl)methyl)amino)propyl)pyrrolidin-2-oneoxalate
Smiles: O=C1O[C@H]2[C@@H](C1CNCCCN1CCCC1=O)CC1[C@](C2)(C)CCCC21OC2

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Saltdata: (COOH)2
Molecular Weight: 390.52
Empirical Formula: C22H34N2O4

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 0.027
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 5

     

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