COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541915
Chemical Name: (12bR)-2-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1cccc(c1Cl)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3

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Molecular Weight: 441.32
Empirical Formula: C22H18Cl2N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.07
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 68
Number of rings: 5

     

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