In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-3-methyl-butanamide (2S)-2-amino-N-[(1S)-1-(2,4-dich…
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) | 2.65 | 5.37 | -45.92 | 4 | 3 | 1 | 57 | 290.214 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 5.03 | -8.21 | 3 | 3 | 0 | 55 | 289.206 | 4 | ↓ |