| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 18 | Yes |
Popular Name: N-[[4-(aminomethyl)-2-furyl]methyl]-1-ethyl-N-methyl-piperidin-4-amine N-[[4-(aminomethyl)-2-furyl]meth…
| 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) | 0.91 | 3.79 | -84.42 | 4 | 4 | 2 | 48 | 253.39 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.91 | 3.37 | -36.05 | 3 | 4 | 1 | 47 | 252.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 6.27 | -170.24 | 5 | 4 | 3 | 50 | 254.398 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 4.02 | -94.2 | 4 | 4 | 2 | 48 | 253.39 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
