| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | No |
Popular Name: (4S)-N-[(S)-cyclopropyl(phenyl)methyl]isothiochroman-4-amine (4S)-N-[(S)-cyclopropyl(phenyl)m…
| 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) | 4.44 | 11.46 | -37.5 | 2 | 1 | 1 | 17 | 296.459 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.44 | 10.62 | -2.58 | 1 | 1 | 0 | 12 | 295.451 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[cyclopropyl(phenyl)methyl]-isothiochroman-4-yl-amine](http://zinc12.docking.org/img/rings/560864.gif)