COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL411236
Chemical Name: 2-(4-ethylpiperazin-1-yl)-N-(5-methyl-6-oxo-5,6-dihydropyrido[2,3-b][1,4]benzothiazepin-8-yl)acetamide
Smiles: CCN1CCN(CC1)CC(=O)Nc1ccc2c(c1)C(=O)N(C)c1c(S2)nccc1

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Saltdata: 2 HCl
Molecular Weight: 411.53
Empirical Formula: C21H25N5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.502
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 4

     

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