In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 21 | Yes |
Popular Name: (1R)-1-(4-tert-butylphenyl)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethanamine (1R)-1-(4-tert-butylphenyl)-2-[(…
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) | 1.74 | 6.48 | -44.79 | 3 | 3 | 1 | 40 | 291.459 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 5.71 | -2.63 | 2 | 3 | 0 | 38 | 290.451 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.74 | 8.06 | -132.37 | 4 | 3 | 2 | 41 | 292.467 | 4 | ↓ |