| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 17 | No |
Popular Name: (1R,2R)-2-methyl-1-phenyl-3-thiomorpholino-propan-1-amine (1R,2R)-2-methyl-1-phenyl-3-thio…
| 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) | 0.59 | 5.7 | -49.65 | 3 | 2 | 1 | 31 | 251.419 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 5.37 | -3.45 | 2 | 2 | 0 | 29 | 250.411 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.59 | 7.46 | -126.22 | 4 | 2 | 2 | 32 | 252.427 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.59 | 7.2 | -36.54 | 3 | 2 | 1 | 30 | 251.419 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
