| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 19 | No |
(1S,2R)-1-C-(indol-3-yl)glycerol 3-phosphate(2-)
1-C-(indol-3-yl)glycerol 3-phosphate
CHEBI:12417; CHEBI:11201; CHEBI:5915; CHEBI:24825
None
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.67 | -5.72 | -139.98 | 3 | 7 | -2 | 128 | 285.192 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 3.87e+00 g/l | DrugBank-experimental |
| UniProt Database Links | HIS4_ARATH; HIS51_CAMJE; HIS51_CAMJJ; HIS51_CAMJR; HIS51_LEGPA; HIS51_LEGPH; HIS51_LEGPL; HIS51_METMP; HIS51_NITWN; HIS51_PROMM; HIS51_PSEAE; HIS51_SYNPX; HIS51_VIBVY; HIS52_CAMJE; HIS52_CAMJR; HIS52_LEGPA; HIS52_LEGPH; HIS52_LEGPL; HIS52_METMP; HIS52_NIT | ChEBI |
| UniProt Database Links | TRBP2_ARATH; TRPA1_ARATH; TRPA1_CYACA; TRPA2_ARATH; TRPA2_CYACA; TRPA_ACAM1; TRPA_ACIAD; TRPA_ACIB3; TRPA_ACIB5; TRPA_ACIBC; TRPA_ACIBS; TRPA_ACIBT; TRPA_ACIBY; TRPA_ACIC1; TRPA_ACICJ; TRPA_ACIET; TRPA_ACIF2; TRPA_ACIF5; TRPA_ACISJ; TRPA_ACTP2; TRPA_ACTP7 | ChEBI |
| UniProt Database Links | TRPA1_ARATH; TRPA2_ARATH; TRPA_MAIZE | ChEBI |
| PUBCHEM_PATENT_ID | WO1998040505A1 | IBM Patent Data |
