In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 15 | Yes |
Popular Name: (2S)-2-amino-3-[methyl-[(2-methyl-3-furyl)methyl]amino]propanoic (2S)-2-amino-3-[methyl-[(2-methy…
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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) | -2.44 | 3.84 | -39.75 | 3 | 5 | 0 | 84 | 212.249 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.44 | 1.81 | -44.12 | 2 | 5 | -1 | 83 | 211.241 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.44 | 2.26 | -34.58 | 3 | 5 | 0 | 84 | 212.249 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.44 | 4.22 | -82.67 | 4 | 5 | 1 | 85 | 213.257 | 5 | ↓ |