In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 16 | Yes |
Popular Name: (1R)-1-(4-pyridyl)-N-(tetrahydropyran-4-ylmethyl)ethanamine (1R)-1-(4-pyridyl)-N-(tetrahydro…
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) | 1.52 | 5.03 | -47.01 | 2 | 3 | 1 | 39 | 221.324 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 3.94 | -4.84 | 1 | 3 | 0 | 34 | 220.316 | 4 | ↓ |