In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 25 | Yes |
Popular Name: 4-[[(4-hydroxy-1-naphthyl)methylamino]methyl]naphthalen-1-ol 4-[[(4-hydroxy-1-naphthyl)methyl…
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) | 4.68 | 7.08 | -54.62 | 4 | 3 | 1 | 57 | 330.407 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.68 | 7.71 | -75.85 | 3 | 3 | 0 | 60 | 329.399 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.68 | 5.63 | -12.81 | 3 | 3 | 0 | 52 | 329.399 | 4 | ↓ |