COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528382
Chemical Name: (3a'S,6a'R)-5'-(2-methyl-5-nitrophenyl)-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C(=O)Nc1c2cccc1

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Molecular Weight: 466.52
Empirical Formula: C23H22N4O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.878
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 149
Number of rings: 5

     

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