| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 18 | Yes |
Popular Name: (1R)-1-(2-furyl)-N,N-dimethyl-N'-(pyrazin-2-ylmethyl)ethane-1,2-diamine (1R)-1-(2-furyl)-N,N-dimethyl-N'…
| 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) | 0.90 | 1.31 | -6.11 | 1 | 5 | 0 | 54 | 246.314 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 3.25 | -38.56 | 2 | 5 | 1 | 55 | 247.322 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.90 | 4.54 | -114.2 | 3 | 5 | 2 | 60 | 248.33 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.90 | 2.67 | -42.68 | 2 | 5 | 1 | 59 | 247.322 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
