In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 14 | Yes |
Popular Name: (2S)-2-amino-3-[ethyl-[(1S)-2-methoxy-1-methyl-ethyl]amino]propanoic (2S)-2-amino-3-[ethyl-[(1S)-2-me…
None
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) | -2.31 | 2.5 | -35.65 | 3 | 5 | 0 | 80 | 204.27 | 7 | ↓ |
Hi High (pH 8-9.5) | -2.31 | 0.53 | -45.32 | 2 | 5 | -1 | 79 | 203.262 | 7 | ↓ |
Mid Mid (pH 6-8) | -2.31 | 1.27 | -33.78 | 3 | 5 | 0 | 80 | 204.27 | 7 | ↓ |
Mid Mid (pH 6-8) | -2.31 | 2.81 | -70.94 | 4 | 5 | 1 | 81 | 205.278 | 7 | ↓ |