| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 14 | Yes |
Popular Name: (3S)-N3-methyl-N3-[(2-methyl-3-furyl)methyl]butane-1,3-diamine (3S)-N3-methyl-N3-[(2-methyl-3-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) | 0.31 | 2.31 | -46.95 | 3 | 3 | 1 | 44 | 197.302 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.31 | 4.29 | -111.38 | 4 | 3 | 2 | 45 | 198.31 | 5 | ↓ |
