In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 21 | Yes |
Popular Name: 1-[2-(3-fluorophenyl)ethyl]-4-(2-thienylmethyl)piperazine 1-[2-(3-fluorophenyl)ethyl]-4-(2…
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) | 3.48 | 9.5 | -43.38 | 1 | 2 | 1 | 8 | 305.442 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 9.45 | -38.19 | 1 | 2 | 1 | 8 | 305.442 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 7.13 | -4.29 | 0 | 2 | 0 | 6 | 304.434 | 5 | ↓ |