| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 19 | Yes |
Popular Name: 1-[2-(isoindolin-2-ylmethyl)phenyl]-N-methyl-methanamine 1-[2-(isoindolin-2-ylmethyl)phen…
| 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) | 2.24 | 9.54 | -112.95 | 3 | 2 | 2 | 21 | 254.377 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 8.91 | -35.83 | 2 | 2 | 1 | 20 | 253.369 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 9.25 | -31.12 | 2 | 2 | 1 | 16 | 253.369 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
