In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (1S)-N-ethyl-1-(2-furyl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1S)-N-ethyl-1-(2-furyl)-N-[[(2R…
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) | 0.74 | 2.7 | -45.69 | 3 | 4 | 1 | 53 | 239.339 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.74 | 2.51 | -4.58 | 2 | 4 | 0 | 52 | 238.331 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 4.4 | -25.86 | 3 | 4 | 1 | 53 | 239.339 | 6 | ↓ |