In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2008 | 27 | Yes |
Popular Name: 2-phenyl-N-(4-pyridylmethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine 2-phenyl-N-(4-pyridylmethyl)-N-[…
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) | 4.50 | 11.68 | -6.69 | 0 | 2 | 0 | 16 | 370.418 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.50 | 13.54 | -108.72 | 2 | 2 | 2 | 19 | 372.434 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.50 | 12.12 | -37.66 | 1 | 2 | 1 | 17 | 371.426 | 8 | ↓ |