In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 15 | Yes |
Popular Name: 1-[4-[(1R)-3-amino-1-ethyl-propyl]piperazin-1-yl]ethanone 1-[4-[(1R)-3-amino-1-ethyl-propy…
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) | -0.46 | 1.34 | -50.43 | 3 | 4 | 1 | 51 | 214.333 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.46 | 0.97 | -7.94 | 2 | 4 | 0 | 50 | 213.325 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.46 | 3.08 | -118.29 | 4 | 4 | 2 | 52 | 215.341 | 4 | ↓ |