COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552967
Chemical Name: (3R,3aR)-3-hydroxy-5-methoxy-9,9-dimethyl-3,3a,8,9,10,11,11a,11b-octahydro[1]benzofuro[4,3,2-efg][2]benzazocin-9-ium
Smiles: COc1ccc2c3c1O[C@@H]1C3C(C=C[C@H]1O)CC[N+](C2)(C)C

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Saltdata: I-
Molecular Weight: 302.39
Empirical Formula: C18H24NO3

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: -2.774
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 38
Number of rings: 4

     

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