In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 21 | Yes |
Popular Name: (2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenyl-butyl]amino]-4-methyl-pentanoic (2S)-2-[[(2S,3R)-3-amino-2-hydro…
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) | -0.45 | 4.41 | -90.21 | 6 | 5 | 1 | 105 | 295.403 | 9 | ↓ |
Mid Mid (pH 6-8) | -0.45 | 4.1 | -33.99 | 5 | 5 | 0 | 103 | 294.395 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4871870; US4983567 | IBM Patent Data |