| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2009 | 12 | Yes |
Popular Name: (2S)-2-amino-N-(2-hydroxyethyl)-4-methylpentanamide hydrochloride (2S)-2-amino-N-(2-hydroxyethyl)-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 27461-78-5 , 80482-77-5
| 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) | -0.70 | -2.64 | -42.59 | 5 | 4 | 1 | 77 | 175.252 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.70 | -2.97 | -8.36 | 4 | 4 | 0 | 75 | 174.244 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 154 - 156 | Enamine Building Blocks |
| MP | 154...156 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0295316A2 | IBM Patent Data |
