In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 20 | Yes |
Popular Name: 1-(3-bromo-4-methoxy-phenyl)-N-[(3,4-difluorophenyl)methyl]methanamine 1-(3-bromo-4-methoxy-phenyl)-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) | 3.94 | 8.33 | -60.19 | 2 | 2 | 1 | 26 | 343.191 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 6.98 | -9.11 | 1 | 2 | 0 | 21 | 342.183 | 5 | ↓ |