| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 14 | Yes |
Popular Name: (3,4-Dihydro-1H-isoquinolin-2-yl)-acetic acid (3,4-Dihydro-1H-isoquinolin-2-yl…
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CAS Numbers: 200064-94-4 , 731810-79-0 , [731810-79-0]
(3,4-Dihydro-1H-isoquinolin-2-yl)-acetic acid hydrochloride
(3,4-Dihydro-1H-isoquinolin-2-yl)-aceticacid
2-(3,4-Dihydroisoquinolin-2(1H)-yl)acetic acid
2-(3,4-Dihydroisoquinolin-2(1H)-yl)acetic acid hydrochloride
3,4-Dihydro-2(1H)-isoquinolineacetic acid
3,4-dihydro-2(1H)-isoquinolinylacetic acid
3,4-dihydro-2(1H)-isoquinolinylacetic acid hydrochloride
| 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) | 0.07 | 7.51 | -32.45 | 1 | 3 | 0 | 45 | 191.23 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 5.32 | -47.45 | 0 | 3 | -1 | 43 | 190.222 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
