| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 20 | Yes |
Popular Name: (1S)-3-isoindolin-2-yl-N-methyl-1-phenyl-propan-1-amine (1S)-3-isoindolin-2-yl-N-methyl-…
| 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) | 2.06 | 7.71 | -40.28 | 2 | 2 | 1 | 20 | 267.396 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 9.16 | -40.34 | 2 | 2 | 1 | 16 | 267.396 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.06 | 10.25 | -117.12 | 3 | 2 | 2 | 21 | 268.404 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
