In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: (3S,4R)-N-propyl-3-[(6S)-2,2,6-trimethylmorpholin-4-yl]heptan-4-amine (3S,4R)-N-propyl-3-[(6S)-2,2,6-t…
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) | 4.32 | 7.39 | -39.15 | 2 | 3 | 1 | 29 | 285.496 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.32 | 8.75 | -111.05 | 3 | 3 | 2 | 30 | 286.504 | 8 | ↓ |