In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 14 | Yes |
Popular Name: N-ethyl-N'-[(1R)-2-(2-furyl)-1-methyl-ethyl]ethane-1,2-diamine N-ethyl-N'-[(1R)-2-(2-furyl)-1-m…
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) | 1.30 | 4.8 | -110.95 | 4 | 3 | 2 | 46 | 198.31 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.30 | 3.62 | -35.93 | 3 | 3 | 1 | 42 | 197.302 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.30 | 3.44 | -36.01 | 3 | 3 | 1 | 42 | 197.302 | 7 | ↓ |