COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK436804
Chemical Name: ethyl2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N=C=S)sc2c1CCCCC2

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Molecular Weight: 281.4
Empirical Formula: C13H15NO2S2

Physical State: Dry powder
Available Amount: 1124 mg

Lipinsky:
logP: 6.447
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 98
Number of rings: 2

     

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