| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 15 | Yes |
Popular Name: 6-Methoxy-1,2,3,4-tetrahydro-naphthalene-2-carboxylic acid 6-Methoxy-1,2,3,4-tetrahydro-nap…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 136759-41-6 , 2471-69-4 , [2471-69-4]
(S)-6-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
6-METHOXY-1,2,3,4-TETRAHYDRO-NAPHTHALENE-2-CARBOXYLICACID
| 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) | 2.28 | 6.84 | -46.84 | 0 | 3 | -1 | 49 | 205.233 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.28 | 4.83 | -7.07 | 1 | 3 | 0 | 47 | 206.241 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5573949; US5719308 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.