COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540880
Chemical Name: (12bS)-7-(2-chlorophenyl)-12b-methyl-2-(3-methylbutyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CC(CCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3)C

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Molecular Weight: 449.98
Empirical Formula: C26H28ClN3O2

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.572
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 5

     

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