COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528965
Chemical Name: (12bS)-2-(3-butoxypropyl)-7-(4-chlorophenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCOCCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccc(cc1)Cl)cccc3

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Molecular Weight: 494.03
Empirical Formula: C28H32ClN3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.452
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 65
Number of rings: 5

     

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