COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047103
Chemical Name: N-[(1Z)-4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1(2H)-ylidene]-1,3-benzodioxol-5-amine
Smiles: Cc1ccc(cc1S(=O)(=O)N1CCCCC1)c1n[nH]/c(=N\c2ccc3c(c2)OCO3)/c2c1cccc2

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Molecular Weight: 502.59
Empirical Formula: C27H26N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.814
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 6

     

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