COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295691
Chemical Name: 2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: O=C1N(c2ccc(cc2)Sc2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C1C=CC2C1

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Molecular Weight: 392.44
Empirical Formula: C21H16N2O4S

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 3.05
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 108
Number of rings: 5

     

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