In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(1S,3S)-1-(hydroxymethyl)-3-methyl-cyclohexyl]-3,3-dimethyl-butanamide (2S)-2-amino-N-[(1S,3S)-1-(hydro…
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) | 1.34 | 1.72 | -39.43 | 5 | 4 | 1 | 77 | 257.398 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 1.41 | -5.66 | 4 | 4 | 0 | 75 | 256.39 | 4 | ↓ |