In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 19 | Yes |
Popular Name: [4-[[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]methyl]-3-fluoro-phenyl]methanamine [4-[[(2S,5R)-5-ethyl-2-methyl-mo…
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) | 2.09 | 3.5 | -50.04 | 3 | 3 | 1 | 40 | 267.368 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 3.09 | -4.3 | 2 | 3 | 0 | 38 | 266.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.09 | 5.65 | -93.66 | 4 | 3 | 2 | 41 | 268.376 | 4 | ↓ |