COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK370495
Chemical Name: methyl3,4-didehydroibogamine-18-carboxylate
Smiles: CCC1=CC2CN3C1C(C2)(C(=O)OC)c1[nH]c2c(c1CC3)cccc2

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Saltdata: COOHCH(O)CH(O)COOH
Molecular Weight: 336.43
Empirical Formula: C21H24N2O2

Physical State: Liquid
Available Amount: 300 mg

Lipinsky:
logP: 4.047
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 45
Number of rings: 6

     

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