In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 16 | Yes |
Popular Name: (2R)-2-amino-3-[cyclopropyl(3-thienylmethyl)amino]propanoic (2R)-2-amino-3-[cyclopropyl(3-th…
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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) | -1.65 | 5.39 | -42.73 | 3 | 4 | 0 | 71 | 240.328 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.65 | 3.7 | -44.07 | 2 | 4 | -1 | 69 | 239.32 | 6 | ↓ |
Mid Mid (pH 6-8) | -1.65 | 4.11 | -32.67 | 3 | 4 | 0 | 71 | 240.328 | 6 | ↓ |
Mid Mid (pH 6-8) | -1.65 | 5.7 | -80.09 | 4 | 4 | 1 | 72 | 241.336 | 6 | ↓ |