In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 13th, 2010 | 19 | Yes |
Popular Name: 1-(3-bromo-4-methoxy-phenyl)-N-[(3-chlorophenyl)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) | 4.34 | 8.72 | -51.99 | 2 | 2 | 1 | 26 | 341.656 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.34 | 7.37 | -6.4 | 1 | 2 | 0 | 21 | 340.648 | 5 | ↓ |