COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588230
Chemical Name: (3a'S,6a'R)-5-bromo-5'-butyl-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)CCCC)C(=O)Nc1c2cc(Br)cc1

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Molecular Weight: 466.4
Empirical Formula: C20H24BrN3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.55
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 103
Number of rings: 4

     

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