COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704729
Chemical Name: 3-[(5Z)-5-{[7-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: CN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCC(=O)O)C

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Saltdata: 1/3CH3COOH
Molecular Weight: 473.58
Empirical Formula: C21H23N5O4S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 0.111
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 154
Number of rings: 4

     

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