| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 17 | No |
Popular Name: (4S)-N-[(1R)-2-cyclopropyl-1-methyl-ethyl]isothiochroman-4-amine (4S)-N-[(1R)-2-cyclopropyl-1-met…
| 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) | 3.46 | 9.49 | -36.46 | 2 | 1 | 1 | 17 | 248.415 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 8.49 | -2.38 | 1 | 1 | 0 | 12 | 247.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
