COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046159
Chemical Name: 4-phenyl-2,3-dihydro-1,5-benzothiazepin-5-ium-2-carboxylate
Smiles: [O-]C(=O)C1Sc2ccccc2[NH+]=C(C1)c1ccccc1

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Molecular Weight: 283.35
Empirical Formula: C16H13NO2S

Physical State: Dry powder
Available Amount: 193 mg

Lipinsky:
logP: 2.463
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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