COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567105
Chemical Name: (3S,3a'R,8a'S,8b'S)-2'-(4-chloro-3-nitrophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc(c(c2)[N+](=O)[O-])Cl)C(=O)[C@H]2[C@@H]1[C@]1(C(=O)Nc3c1cccc3)N1[C@H]2CCC1

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Molecular Weight: 452.85
Empirical Formula: C22H17ClN4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.315
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 115
Number of rings: 6

     

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