In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 18 | Yes |
Popular Name: 1-[(2S)-4-[(4-methoxyphenyl)methyl]morpholin-2-yl]-N-methyl-methanamine 1-[(2S)-4-[(4-methoxyphenyl)meth…
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) | 1.42 | 2.98 | -38.8 | 2 | 4 | 1 | 38 | 251.35 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.42 | 1.55 | -4.33 | 1 | 4 | 0 | 34 | 250.342 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.42 | 5.25 | -103.69 | 3 | 4 | 2 | 40 | 252.358 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.