In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 22 | Yes |
Popular Name: benzenemethanamine, N-[(2-chlorophenyl)methyl]-3-methoxy-4-(1-methylethoxy)- benzenemethanamine, N-[(2-chloro…
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) | 3.91 | 9.43 | -45.35 | 2 | 3 | 1 | 35 | 320.84 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 8.05 | -7.52 | 1 | 3 | 0 | 30 | 319.832 | 7 | ↓ |