| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: N-[[(2R,3S)-4-methyl-3-(3-thienyl)morpholin-2-yl]methyl]ethanamine N-[[(2R,3S)-4-methyl-3-(3-thieny…
| 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) | 1.16 | 3.53 | -34.36 | 2 | 3 | 1 | 29 | 241.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 2.09 | -2.43 | 1 | 3 | 0 | 24 | 240.372 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.16 | 5.4 | -100.73 | 3 | 3 | 2 | 30 | 242.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
