| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | No |
Popular Name: (4S)-N-[(1R)-2-(3-chlorophenyl)-1-methyl-ethyl]isothiochroman-4-amine (4S)-N-[(1R)-2-(3-chlorophenyl)-…
| 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) | 4.78 | 10.59 | -4.24 | 1 | 1 | 0 | 12 | 317.885 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.78 | 11.52 | -39.21 | 2 | 1 | 1 | 17 | 318.893 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
