In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (1S,2R)-2-[(6S)-2,2,6-trimethylmorpholin-4-yl]cycloheptanamine (1S,2R)-2-[(6S)-2,2,6-trimethylm…
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) | 2.13 | 3.54 | -1.61 | 2 | 3 | 0 | 38 | 240.391 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 5 | -123.7 | 4 | 3 | 2 | 41 | 242.407 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 5.47 | -32.33 | 3 | 3 | 1 | 40 | 241.399 | 1 | ↓ |