COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531143
Chemical Name: (4aS,9bR)-2,8-dimethyl-5-[(4-nitrophenyl)sulfonyl]-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indole
Smiles: CN1CC[C@H]2[C@@H](C1)c1cc(C)ccc1N2S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: HCl
Molecular Weight: 387.46
Empirical Formula: C19H21N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.065
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 94
Number of rings: 4

     

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