| Phytochemical Name : Guvacoline |
| PCNDIDG0155 |
| Pubchem CID : 160492 |
| Molecular formula: C7H11NO2 |
| Canonical SMILES : COC(=O)C1=CCCNC1 |
Synonymes : Guvacoline|methyl 1,2,5,6-tetrahydropyridine-3-carboxylate|495-19-2|Guvacine methyl ester|Methyl 1,2,5,6-tetrahydro-3-pyridinecarboxylate|Guvacine free base|methyl 1,2,3,6-tetrahydropyridine-5-carboxylate|Methyl 1,2,5,6-tetrahydronicotinate|UNII-YT3OF85P98|CHEMBL268808|YT3OF85P98|498-96-4 (free base)|CHEBI:80754|3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-, methyl ester|3-(Methoxycarbonyl)-1,2,5,6-tetrahydropyridine|SCHEMBL3019132|DTXSID20197805|BDBM50024984|AKOS006326662|SB53050|FT-0626845|FT-0626846|EN300-261947|F14151|Nicotinic acid, 1,2,5,6-tetrahydro-, methyl ester|Q27149807|1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid methyl ester |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 1.920 |
| Log Po/w (XLOGP3) : 0.060 |
| Log Po/w (WLOGP) : -0.300 |
| Log Po/w (MLOGP) : 0.250 |
| Log Po/w (SILICOS-IT) : 0.890 |
| Consensus Log Po/w : 0.560 |