COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009054
Chemical Name: 4-nitro-2-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1c2ccccc2Sc2c1cccc2)CN1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

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Molecular Weight: 431.43
Empirical Formula: C22H13N3O5S

Physical State: Dry powder
Available Amount: 458 mg

Lipinsky:
logP: 3.694
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 128
Number of rings: 5

     

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