| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2010 | 25 | Yes |
Popular Name: 3-[[[5-(4-isoquinolyl)-3-pyridyl]amino]methyl]phenol 3-[[[5-(4-isoquinolyl)-3-pyridyl…
| 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) | 3.82 | 6.3 | -9.28 | 2 | 4 | 0 | 58 | 327.387 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.82 | 6.76 | -39.86 | 3 | 4 | 1 | 59 | 328.395 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.82 | 6.76 | -39.14 | 3 | 4 | 1 | 59 | 328.395 | 4 | ↓ |
