In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 15 | Yes |
Popular Name: (2S)-2-amino-3-[cyclohexylmethyl(methyl)amino]propanoic (2S)-2-amino-3-[cyclohexylmethyl…
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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) | -0.72 | 5.46 | -45.64 | 3 | 4 | 0 | 71 | 214.309 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.72 | 4.18 | -32.67 | 3 | 4 | 0 | 71 | 214.309 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.72 | 5.78 | -83.22 | 4 | 4 | 1 | 72 | 215.317 | 5 | ↓ |