In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: 5-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pentan-1-amine 5-[4-[(3-fluorophenyl)methyl]pip…
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) | 1.62 | 6.26 | -94.4 | 4 | 3 | 2 | 35 | 281.419 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 6.25 | -90.42 | 4 | 3 | 2 | 35 | 281.419 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 3.99 | -43.56 | 3 | 3 | 1 | 34 | 280.411 | 7 | ↓ |