COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539129
Chemical Name: 3-(3-acetyl-1H-indol-1-yl)-1-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]propan-1-one
Smiles: O=C(N1CC[C@@]2([C@H](C1)CCCC2)O)CCn1cc(c2c1cccc2)C(=O)C

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Molecular Weight: 368.48
Empirical Formula: C22H28N2O3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.247
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 4

     

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