In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2011 | 18 | Yes |
Popular Name: N-[2-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]ethyl]tetrahydropyran-4-amine N-[2-[(2R,5S)-5-ethyl-2-methyl-m…
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) | 1.58 | 2.74 | -43.18 | 2 | 4 | 1 | 38 | 257.398 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.58 | 1.55 | -3.52 | 1 | 4 | 0 | 34 | 256.39 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 4.9 | -121.68 | 3 | 4 | 2 | 40 | 258.406 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.