COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL006543
Chemical Name: methyl3-isothiocyanato-5-methyl-1H-indole-2-carboxylate
Smiles: S=C=Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

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Molecular Weight: 246.29
Empirical Formula: C12H10N2O2S

Available Amount: 0 mg

Lipinsky:
logP: 4.857
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 2

     

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