COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149367
Chemical Name: 2-[(4-chlorophenyl)sulfanyl]-5-nitrobenzoicacid
Smiles: Clc1ccc(cc1)Sc1ccc(cc1C(=O)O)[N+](=O)[O-]

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Molecular Weight: 309.73
Empirical Formula: C13H8ClNO4S

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 4.927
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 108
Number of rings: 2

     

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