COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL199618
Chemical Name: propan-2-yl5-amino-2-thiocyanatobenzoate
Smiles: CC(OC(=O)c1cc(N)ccc1SC#N)C

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Molecular Weight: 236.29
Empirical Formula: C11H12N2O2S

Physical State: Dry powder
Available Amount: 999 mg

Lipinsky:
logP: 2.314
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 101
Number of rings: 1

     

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