In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | Yes |
Popular Name: 2-[2-[[[(1S,3S)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]methyl]phenoxy]acetonitrile 2-[2-[[[(1S,3S)-1-(hydroxymethyl…
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) | 2.64 | 5.76 | -34.1 | 3 | 4 | 1 | 70 | 289.399 | 6 | ↓ |