In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 14 | Yes |
Popular Name: (3R)-3-amino-3-(2-hydroxy-4-methyl-phenyl)propanamide (3R)-3-amino-3-(2-hydroxy-4-meth…
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) | -1.21 | -1.86 | -41.15 | 6 | 4 | 1 | 91 | 195.242 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.21 | -2.21 | -8.89 | 5 | 4 | 0 | 89 | 194.234 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5334225 | IBM Patent Data |