In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 18 | Yes |
Popular Name: 2-[[(1R)-2-(diethylamino)-1-methyl-ethyl]amino]-N-isopentyl-acetamide 2-[[(1R)-2-(diethylamino)-1-meth…
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) | 2.47 | 6.31 | -33.64 | 3 | 4 | 1 | 46 | 258.43 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 4.26 | -37.08 | 3 | 4 | 1 | 49 | 258.43 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 6.05 | -110.73 | 4 | 4 | 2 | 50 | 259.438 | 10 | ↓ |