In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 3-(cyclopropylamino)-1-[4-(3-pyridylmethyl)piperazin-1-yl]propan-1-one 3-(cyclopropylamino)-1-[4-(3-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) | 0.14 | 4.67 | -46.81 | 2 | 5 | 1 | 53 | 289.403 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 6.89 | -105.42 | 3 | 5 | 2 | 54 | 290.411 | 6 | ↓ |