In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 18 | Yes |
Popular Name: (2S)-2-[acetyl(2-pyridylmethyl)amino]-3-methyl-butanoic (2S)-2-[acetyl(2-pyridylmethyl)a…
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) | -1.17 | 6.61 | -47.35 | 0 | 5 | -1 | 73 | 249.29 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.17 | 6.75 | -43.47 | 1 | 5 | 0 | 75 | 250.298 | 5 | ↓ |