COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673281
Chemical Name: 3-methyl-N-[(4Z)-1-(2-methyl-5-nitrophenyl)-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-4-ylidene]aniline
Smiles: CSC1=N/C(=N\c2cccc(c2)C)/C2(N1c1cc(ccc1C)[N+](=O)[O-])CCCCC2

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Saltdata: HI
Molecular Weight: 422.55
Empirical Formula: C23H26N4O2S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 6.537
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 99
Number of rings: 4

     

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