COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052474
Chemical Name: 2-(2,5-dimethyl-1H-indol-3-yl)ethanamine2,3-dihydroxybutanedioate(salt)
Smiles: OC(C(C(=O)O)O)C(=O)O.NCCc1c(C)[nH]c2c1cc(C)cc2

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Saltdata: HOOCC(OH)C(OH)COOH
Molecular Weight: 338.36
Empirical Formula: C16H22N2O6

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 0
Rotatable bonds: 9
H-donors: 7
H-acceptors: 6
PSA: 156
Number of rings: 2

     

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