COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL242052
Chemical Name: 4-(2,1,3-benzothiadiazol-4-ylamino)-2-[(4-methylpiperazin-1-yl)methyl]-4-oxobutanoicacid
Smiles: CN1CCN(CC1)CC(C(=O)O)CC(=O)Nc1cccc2c1nsn2

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Molecular Weight: 363.44
Empirical Formula: C16H21N5O3S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.482
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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