| Phytochemical Name : Indole-3-carboxylic acid |
| PCNDIDI0019 |
| Pubchem CID : 69867 |
| Molecular formula: C9H7NO2 |
| Canonical SMILES : C1=CC=C2C(=C1)C(=CN2)C(=O)O |
Synonymes : Indole-3-carboxylic acid|771-50-6|1H-Indole-3-carboxylic acid|3-Indoleformic acid|3-Carboxyindole|3-Indolecarboxylic acid|Indole-3-carboxylicacid|3-Indolylcarboxylic acid|indole-3-carboxylate|MFCD00005624|CHEBI:24809|EINECS 212-231-6|.beta.-Indolylcarboxylic acid|UNII-59711R38B0|59711R38B0|beta-Indolylcarboxylic acid|ICO|3-Indoleformate|4ahu|3-indolecarboxylic|3-Indolecarboxylate|3-indole carboxylic|3-Indolylcarboxylate|3-Indolecarboxylicacid|Tropisetron impurity B|Indole - 3 Carboxylate|Indole 3-carboxylic acid|Indole-3 carboxylic acid|3-Indole Carboxylic acid|Indole - 3 Carboxylic acid|Oprea1_560034|SCHEMBL64182|CHEMBL387527|BDBM93015|Indole-3-carboxylic acid, 99%|AMY2761|DTXSID50227886|BCP26648|CS-D0682|s4860|STK500561|INDOLE-.BETA.-CARBOXYLIC ACID|AKOS001071938|AC-2264|CCG-266287|FS-1053|SB14951|SDCCGMLS-0065969.P001|NCGC00323250-01|HY-40161|LS-81440|SY004104|1-(2-methoxyphenyl)piperazinehydrochloride|A9767|FT-0627218|I0028|3-Indoleformic acid;Indole-3-carboxylic Acid|EN300-13123|C19837|I-2320|AB00443727-03|Indole-3-carboxylic acid, ReagentPlus(R), 99%|Indole-3-carboxylic acid, purum, >=98.0% (T)|J-400967|Q-102571|Q27103090|Z89283908|F2147-0150|Indole-3-carboxylic acid, Vetec(TM) reagent grade, 98%|TROPISETRON HYDROCHLORIDE IMPURITY B [EP IMPURITY]|Tropisetron impurity B, European Pharmacopoeia (EP) Reference Standard|Indole-3-carboxylic acid pound>>1H-Indole-3-carboxylic acid pound>>3-Carboxyindole |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.000 |
| Log Po/w (XLOGP3) : 1.990 |
| Log Po/w (WLOGP) : 1.870 |
| Log Po/w (MLOGP) : 1.080 |
| Log Po/w (SILICOS-IT) : 1.890 |
| Consensus Log Po/w : 1.560 |