In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: (2R)-2-amino-1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]pentan-1-one (2R)-2-amino-1-[4-(5-bromo-2-pyr…
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) | 1.63 | 5.34 | -49.85 | 3 | 5 | 1 | 64 | 342.261 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.63 | 5 | -10.16 | 2 | 5 | 0 | 62 | 341.253 | 4 | ↓ |