COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045740
Chemical Name: 2-(2-methyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)ethanamine2,3-dihydroxybutanedioate(salt)
Smiles: OC(=O)C(C(C(=O)O)O)O.NCCc1c(C)n2c3c1cccc3CCC2

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Saltdata: HOOCC(OH)C(OH)COOH
Molecular Weight: 364.4
Empirical Formula: C18H24N2O6

Physical State: Dry powder
Available Amount: 246 mg

Lipinsky:
logP: 0
Rotatable bonds: 9
H-donors: 6
H-acceptors: 6
PSA: 146
Number of rings: 3

     

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