| Phytochemical Name : Annomontine |
| PCNDIDA0147 |
| Pubchem CID : 5257090 |
| Molecular formula: C15H11N5 |
| Canonical SMILES : C1=CC=C2C(=C1)C3=C(N2)C(=NC=C3)C4=NC(=NC=C4)N |
Synonymes : Annomontine|82504-00-5|CHEBI:65409|4-(9H-pyrido[3,4-b]indol-1-yl)pyrimidin-2-amine|4-(9H-beta-carbolin-1-yl)pyrimidin-2-amine|2-Pyrimidinamine, 4-(9H-pyrido(3,4-b)indol-1-yl)-|CHEMBL501413|SCHEMBL2994062|DTXSID401240801|1-(2-amino-4-pyrimidinyl)-b-carboline|4-(9H-Pyrido[3,4-b]indol-1-yl)-2-pyrimidinamine|Q27133852 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.220 |
| Log Po/w (XLOGP3) : 1.950 |
| Log Po/w (WLOGP) : 2.760 |
| Log Po/w (MLOGP) : 0.990 |
| Log Po/w (SILICOS-IT) : 2.710 |
| Consensus Log Po/w : 2.130 |