| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 18 | Yes |
Popular Name: N-[[5-(aminomethyl)-4-methyl-2-furyl]methyl]-N,1-dimethyl-piperidin-4-amine N-[[5-(aminomethyl)-4-methyl-2-f…
| 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) | 1.22 | 6.4 | -169.4 | 5 | 4 | 3 | 50 | 254.398 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 3.91 | -87.06 | 4 | 4 | 2 | 48 | 253.39 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 4 | -95.46 | 4 | 4 | 2 | 48 | 253.39 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
