In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-1-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)propan-2-amine (1S,2S)-1-(4-ethylpiperazin-1-yl…
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) | 1.56 | 5.82 | -100.6 | 4 | 3 | 2 | 35 | 267.392 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 3.66 | -45.67 | 3 | 3 | 1 | 34 | 266.384 | 4 | ↓ |