| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 20 | Yes |
Popular Name: 4-[(3S)-3-[[(1R)-1-(5-bromo-2-thienyl)ethyl]amino]butyl]phenol 4-[(3S)-3-[[(1R)-1-(5-bromo-2-th…
| 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) | 5.06 | 7.93 | -44.01 | 3 | 2 | 1 | 37 | 355.321 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.06 | 6.82 | -4.7 | 2 | 2 | 0 | 32 | 354.313 | 6 | ↓ |
