| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2011 | 20 | Yes |
Popular Name: (2S)-1-[5-(5-isoquinolyl)-2-furyl]-N-methyl-propan-2-amine (2S)-1-[5-(5-isoquinolyl)-2-fury…
| 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) | 3.47 | 8.15 | -38.06 | 2 | 3 | 1 | 43 | 267.352 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.47 | 8.62 | -81.43 | 3 | 3 | 2 | 44 | 268.36 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
