COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557538
Chemical Name: (3aR,4S,11aR,11bS)-4-(4-bromophenyl)-2-(4-chlorophenyl)-3a,4,6,11,11a,11b-hexahydro-1H-pyrrolo[3',4':3,4]pyrrolo[1,2-b]isoquinoline-1,3(2H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2Cc2ccccc2C1)c1ccc(cc1)Br

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Molecular Weight: 507.81
Empirical Formula: C26H20BrClN2O2

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 6.238
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 40
Number of rings: 6

     

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