In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 18 | Yes |
Popular Name: (1S,2R)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]indan-1-amine (1S,2R)-2-[(2S,6S)-2,6-dimethylm…
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) | 0.01 | 4.58 | -41.91 | 3 | 3 | 1 | 40 | 247.362 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 4.25 | -3.37 | 2 | 3 | 0 | 38 | 246.354 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.01 | 6.19 | -125.16 | 4 | 3 | 2 | 41 | 248.37 | 1 | ↓ |