In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2006 | 21 | Yes |
Popular Name: 1-(3-bromo-4-ethoxy-5-methoxy-phenyl)-N-(4-pyridylmethyl)methanamine 1-(3-bromo-4-ethoxy-5-methoxy-ph…
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) | 2.56 | 7.41 | -58.64 | 2 | 4 | 1 | 48 | 352.252 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 7.69 | -117.13 | 3 | 4 | 2 | 49 | 353.26 | 7 | ↓ |