In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: (2R,4S,5R)-N-(4-methoxybutyl)-1,2,5-trimethyl-piperidin-4-amine (2R,4S,5R)-N-(4-methoxybutyl)-1,…
None
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) | 1.85 | 5.28 | -31.78 | 2 | 3 | 1 | 26 | 229.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 6.32 | -100.34 | 3 | 3 | 2 | 30 | 230.396 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 4.35 | -39.3 | 2 | 3 | 1 | 29 | 229.388 | 6 | ↓ |