In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | Yes |
Popular Name: [1-[(5-bromo-2-pyridyl)methylamino]cyclopentyl]methanol [1-[(5-bromo-2-pyridyl)methylami…
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) | 2.14 | 3.07 | -35.91 | 3 | 3 | 1 | 50 | 286.193 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 1.83 | -5.94 | 2 | 3 | 0 | 45 | 285.185 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.