| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2009 | 24 | Yes |
Popular Name: [4-[(3R)-3-[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]butyl]phenyl] [4-[(3R)-3-[[(2S)-2-hydroxy-2-ph…
| 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) | 3.12 | 9.27 | -50.13 | 3 | 4 | 1 | 63 | 328.432 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 8.17 | -9.49 | 2 | 4 | 0 | 59 | 327.424 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4391826; US4845127 | IBM Patent Data |
