| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 19 | No |
Popular Name: (4S)-N-(3-imidazol-1-ylpropyl)isothiochroman-4-amine (4S)-N-(3-imidazol-1-ylpropyl)is…
| 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) | 1.94 | 10.56 | -103.41 | 3 | 3 | 2 | 36 | 275.421 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 9.21 | -8.55 | 1 | 3 | 0 | 30 | 273.405 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 10.05 | -53.34 | 2 | 3 | 1 | 34 | 274.413 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
