In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 19 | Yes |
Popular Name: (1R,2S)-3-methyl-2-[(3S)-3-methylmorpholin-4-yl]-1-phenyl-butan-1-amine (1R,2S)-3-methyl-2-[(3S)-3-methy…
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) | 0.74 | 3.69 | -47.14 | 3 | 3 | 1 | 40 | 263.405 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.74 | 3.32 | -2.98 | 2 | 3 | 0 | 38 | 262.397 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.74 | 5.53 | -112.05 | 4 | 3 | 2 | 41 | 264.413 | 4 | ↓ |