COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541242
Chemical Name: (6aR,6bS,9aR,10S)-10-[(4-bromophenyl)carbonyl]-2-chloro-8-(2-methyl-4-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 592.83
Empirical Formula: C28H19BrClN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.625
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 103
Number of rings: 6

     

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