In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: N'-[(1S)-2-(2-furyl)-1-methyl-ethyl]-N-[(1R)-1-methylpropyl]ethane-1,2-diamine N'-[(1S)-2-(2-furyl)-1-methyl-et…
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) | 2.48 | 6.17 | -109.21 | 4 | 3 | 2 | 46 | 226.364 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 5.01 | -35.24 | 3 | 3 | 1 | 42 | 225.356 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 5.12 | -34.39 | 3 | 3 | 1 | 42 | 225.356 | 8 | ↓ |