| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | Yes |
Popular Name: (2S,3R)-N1,3-dimethyl-N1-[(2-methyl-3-furyl)methyl]pentane-1,2-diamine (2S,3R)-N1,3-dimethyl-N1-[(2-met…
| 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) | 1.40 | 6.22 | -123.33 | 4 | 3 | 2 | 45 | 226.364 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 5.85 | -33.12 | 3 | 3 | 1 | 44 | 225.356 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 4.27 | -41.05 | 3 | 3 | 1 | 44 | 225.356 | 6 | ↓ |
