In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2011 | 18 | Yes |
Popular Name: N'-(benzofuran-2-ylmethyl)-N-cyclopropyl-N-methyl-ethane-1,2-diamine N'-(benzofuran-2-ylmethyl)-N-cyc…
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) | 2.46 | 8.48 | -117.25 | 3 | 3 | 2 | 34 | 246.354 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.46 | 4.67 | -4.93 | 1 | 3 | 0 | 28 | 244.338 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 7.13 | -35.77 | 2 | 3 | 1 | 30 | 245.346 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 6.04 | -43.75 | 2 | 3 | 1 | 33 | 245.346 | 6 | ↓ |