In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 19 | Yes |
Popular Name: N'-isopropyl-N-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-N-methyl-ethane-1,2-diamine N'-isopropyl-N-[(4-methoxy-3,5-d…
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) | 2.23 | 4.76 | -83.46 | 3 | 4 | 2 | 43 | 267.417 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 3.09 | -4.6 | 1 | 4 | 0 | 37 | 265.401 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 5.45 | -34.95 | 2 | 4 | 1 | 39 | 266.409 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 4.28 | -39.38 | 2 | 4 | 1 | 42 | 266.409 | 7 | ↓ |