COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK296401
Chemical Name: N-{4-[(4-nitrophenyl)sulfanyl]phenyl}-2-[3-({4-[(4-nitrophenyl)sulfanyl]phenyl}carbamoyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C(=O)Nc1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 767.8
Empirical Formula: C40H25N5O8S2

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 6.602
Rotatable bonds: 2
H-donors: 2
H-acceptors: 8
PSA: 237
Number of rings: 7

     

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