| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 19 | Yes |
Popular Name: (2S)-2-isoindolin-2-yl-N-(2-thienylmethyl)propan-1-amine (2S)-2-isoindolin-2-yl-N-(2-thie…
| 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) | 2.74 | 8.25 | -36.55 | 2 | 2 | 1 | 16 | 273.425 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.74 | 6.95 | -42.66 | 2 | 2 | 1 | 20 | 273.425 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
