In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2011 | 20 | Yes |
Popular Name: N-[2-[2-(aminomethyl)phenoxy]ethyl]-N-methyl-2-pyrrolidin-1-yl-ethanamine N-[2-[2-(aminomethyl)phenoxy]eth…
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) | 1.59 | 5.03 | -85.98 | 4 | 4 | 2 | 45 | 279.428 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 4.62 | -33.89 | 3 | 4 | 1 | 43 | 278.42 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 7.37 | -192.57 | 5 | 4 | 3 | 46 | 280.436 | 8 | ↓ |