| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 9 | No |
Popular Name: 3-Sulfinoalanine 3-Sulfinoalanine
Find On: PubMed — Wikipedia — Google
CAS Number: 1115-65-7
(2R)-2-amino-3-sulfonylpropanoic acid
L-CYSTEINE_SULFINATE; L-cysteine sulfinate; cysteine sulfinate; cysteine sulphinate
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) | -3.84 | -3.15 | -44.67 | 3 | 5 | 0 | 102 | 153.159 | 3 | ↓ |
| Hi High (pH 8-9.5) | -3.84 | -3.49 | -44.88 | 2 | 5 | -1 | 100 | 152.151 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 5.46e+01 g/l | DrugBank-experimental |
| PUBCHEM_PATENT_ID | EP0021676A1; EP0050965A1; EP0053815A1; EP0053816A1; EP0229012A1; EP0229012B1; EP0229313A2; EP0249909A1; EP0250096A1; EP0253337A2; EP0271829A2; EP0271829B1; US4416817; US4550105; US4665067; US4675397; US4683303; US4684722; US4725591; US4782147; US4822788 | IBM Patent Data |
