In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: N-[3-(4-aminophenoxy)propyl]-N',N'-dimethyl-N-propyl-ethane-1,2-diamine N-[3-(4-aminophenoxy)propyl]-N',…
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) | 2.28 | 5.93 | -37.54 | 3 | 4 | 1 | 43 | 280.436 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 3.46 | -4.16 | 2 | 4 | 0 | 42 | 279.428 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 8.07 | -109.8 | 4 | 4 | 2 | 44 | 281.444 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 5.6 | -37.22 | 3 | 4 | 1 | 43 | 280.436 | 10 | ↓ |