COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540846
Chemical Name: (6aR,6bS,9aR,10S)-8-(4-bromophenyl)-10-[(4-bromophenyl)carbonyl]-2-chloro-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1cc(Cl)ccc1C=C2)c1ccc(cc1)Br

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Molecular Weight: 612.7
Empirical Formula: C27H17Br2ClN2O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 6.206
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 57
Number of rings: 6

     

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