In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 20 | Yes |
Popular Name: (2S)-2-[[4-(2-aminoethylcarbamoyl)benzoyl]amino]propanoic (2S)-2-[[4-(2-aminoethylcarbamoy…
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) | -2.75 | 0.97 | -85.54 | 5 | 7 | 0 | 126 | 279.296 | 6 | ↓ |
Hi High (pH 8-9.5) | -2.75 | 0.55 | -47.53 | 4 | 7 | -1 | 124 | 278.288 | 6 | ↓ |