In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 6-amino-1-[4-(4-pyridylmethyl)piperazin-1-yl]hexan-1-one 6-amino-1-[4-(4-pyridylmethyl)pi…
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) | 0.02 | 3.61 | -51.05 | 3 | 5 | 1 | 64 | 291.419 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.02 | 5.83 | -103.21 | 4 | 5 | 2 | 65 | 292.427 | 7 | ↓ |