COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK535966
Chemical Name: 1-[4-(4-chlorophenyl)-3'-(2-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: Clc1ccc(cc1)C1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccccc1[N+](=O)[O-])C(=O)C

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Molecular Weight: 554.03
Empirical Formula: C29H20ClN5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.635
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 119
Number of rings: 6

     

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