In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 16 | Yes |
Popular Name: (2S)-2-(4-ethylpiperazin-1-yl)-2-(2-thienyl)ethanamine (2S)-2-(4-ethylpiperazin-1-yl)-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) | 0.90 | 3.58 | -102.38 | 4 | 3 | 2 | 35 | 241.404 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 1.2 | -47.14 | 3 | 3 | 1 | 34 | 240.396 | 4 | ↓ |