In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 19 | Yes |
Popular Name: (1S)-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N-methyl-1-phenyl-propan-1-amine (1S)-3-[(2S,6S)-2,6-dimethylmorp…
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) | 1.65 | 4.92 | -3 | 1 | 3 | 0 | 24 | 262.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 6.04 | -41.65 | 2 | 3 | 1 | 29 | 263.405 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 6.88 | -35.14 | 2 | 3 | 1 | 26 | 263.405 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 7.98 | -117.25 | 3 | 3 | 2 | 30 | 264.413 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.