In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 19 | Yes |
Popular Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]-1-phenyl-propan-1-one 3-[4-(2-hydroxyethyl)piperazin-1…
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) | 1.02 | 3.81 | -43.06 | 2 | 4 | 1 | 45 | 263.361 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 1.56 | -9.17 | 1 | 4 | 0 | 44 | 262.353 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 3.91 | -38.73 | 2 | 4 | 1 | 45 | 263.361 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.