In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-N-[(1S)-1-(3-hydroxyphenyl)ethyl]-3-methyl-butanamide (2S)-2-amino-N-[(1S)-1-(3-hydrox…
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) | 0.86 | 1.53 | -45.6 | 5 | 4 | 1 | 77 | 237.323 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 1.23 | -7.84 | 4 | 4 | 0 | 75 | 236.315 | 4 | ↓ |