In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (1R,2S)-3-methyl-1-phenyl-2-[(6R)-2,2,6-trimethylmorpholin-4-yl]butan-1-amine (1R,2S)-3-methyl-1-phenyl-2-[(6R…
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 | 6.03 | -45.78 | 3 | 3 | 1 | 40 | 291.459 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.58 | 5.37 | -3.07 | 2 | 3 | 0 | 38 | 290.451 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 7.53 | -111.16 | 4 | 3 | 2 | 41 | 292.467 | 4 | ↓ |