| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 19 | No |
Popular Name: (4S)-N-[(5-methylpyrazin-2-yl)methyl]isothiochroman-4-amine (4S)-N-[(5-methylpyrazin-2-yl)me…
| 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) | 2.14 | 5.39 | -6.55 | 1 | 3 | 0 | 38 | 271.389 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 6.61 | -43.52 | 2 | 3 | 1 | 42 | 272.397 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
