| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 19 | No |
Popular Name: (4S)-N-[(1S)-1-methyl-2-pyrazol-1-yl-ethyl]isothiochroman-4-amine (4S)-N-[(1S)-1-methyl-2-pyrazol-…
| 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) | 2.39 | 7.94 | -32.89 | 2 | 3 | 1 | 34 | 274.413 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 7.58 | -6.1 | 1 | 3 | 0 | 30 | 273.405 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
