In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 18 | Yes |
Popular Name: (2S)-2-[(4-ethylpiperazine-1-carbonyl)-methyl-amino]butanoic (2S)-2-[(4-ethylpiperazine-1-car…
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) | -0.84 | 7 | -72.08 | 1 | 6 | 0 | 68 | 257.334 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.84 | 4.78 | -49.83 | 0 | 6 | -1 | 67 | 256.326 | 4 | ↓ |