In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 21 | Yes |
Popular Name: 3-pyridinemethanamine, N-[2-[5-methyl-2-(1-methylethyl)phenoxy]ethyl]- 3-pyridinemethanamine, N-[2-[5-m…
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) | 3.36 | 8.85 | -46.86 | 2 | 3 | 1 | 39 | 285.411 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.36 | 9.13 | -107.13 | 3 | 3 | 2 | 40 | 286.419 | 7 | ↓ |