COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK010546
Chemical Name: {[(4E)-4-[(4-chlorophenyl)imino]-1-(cyanomethyl)-1,3-diazaspiro[4.4]non-2-en-2-yl]sulfanyl}aceticacid
Smiles: N#CCN1C(=N/C(=N/c2ccc(cc2)Cl)/C21CCCC2)SCC(=O)O

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Saltdata: HI
Molecular Weight: 376.87
Empirical Formula: C17H17ClN4O2S

Available Amount: 0 mg

Lipinsky:
logP: 3.822
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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