COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL034105
Chemical Name: methyl4-[(thiocyanatoacetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSC#N

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Molecular Weight: 250.28
Empirical Formula: C11H10N2O3S

Physical State: Dry powder
Available Amount: 4000 mg

Lipinsky:
logP: 2.149
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 1

     

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