COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528794
Chemical Name: (12bS)-7-(2-ethoxy-3-methoxyphenyl)-2-(5-hydroxypentyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCCCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1cccc(c1OCC)OC)cccc3

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Molecular Weight: 505.61
Empirical Formula: C29H35N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.424
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 95
Number of rings: 5

     

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