In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 31 | Yes |
Popular Name: 1-((cyclohexyl((2-hydroxy-1-naphthyl)methyl)amino)methyl)-2-naphthol; nsc47949 1-((cyclohexyl((2-hydroxy-1-naph…
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) | 7.25 | 13.38 | -37.64 | 3 | 3 | 1 | 45 | 412.553 | 5 | ↓ |
Hi High (pH 8-9.5) | 7.25 | 14.37 | -21.39 | 2 | 3 | 0 | 48 | 411.545 | 5 | ↓ |