In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2S)-2-[(4-tert-butylpiperazine-1-carbonyl)amino]propanoic (2S)-2-[(4-tert-butylpiperazine-…
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) | -0.26 | 5.45 | -58.75 | 2 | 6 | 0 | 77 | 257.334 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.26 | 3.4 | -42.97 | 1 | 6 | -1 | 76 | 256.326 | 3 | ↓ |