In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 18 | Yes |
Popular Name: 1-[5-bromo-2-(3-pyridylmethoxy)phenyl]-N-methyl-methanamine 1-[5-bromo-2-(3-pyridylmethoxy)p…
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) | 2.65 | 6.57 | -40.04 | 2 | 3 | 1 | 39 | 308.199 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 5.11 | -5.71 | 1 | 3 | 0 | 34 | 307.191 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 7.04 | -92.15 | 3 | 3 | 2 | 40 | 309.207 | 5 | ↓ |