COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL222092
Chemical Name: (3aS,4R,9bR)-4-(3-bromophenyl)-8,9-dimethyl-6-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: Brc1cccc(c1)[C@@H]1Nc2c([C@H]3[C@@H]1CC=C3)c(C)c(cc2[N+](=O)[O-])C

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Molecular Weight: 399.29
Empirical Formula: C20H19BrN2O2

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 6
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 57
Number of rings: 4

     

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