| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2005 | 20 | No |
Popular Name: Glutathione Glutathione
Find On: PubMed — Wikipedia — Google
CAS Numbers: 70-18-8 , 76946-74-2 , [70-18-8]
2-amino-4-({1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl}carbamoyl)butanoic acid
| 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) | -4.97 | -0.4 | -80.45 | 5 | 9 | -1 | 166 | 306.32 | 9 | ↓ |
| Hi High (pH 8-9.5) | -4.97 | -0.71 | -90.96 | 4 | 9 | -2 | 164 | 305.312 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 6.06 | -92.96 | 7 | 7 | 2 | 113 | 440.498 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 192 - 195 | Enamine Building Blocks |
| MP | 192...195 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.