In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-(2-pyrrolidin-1-yl-3-pyridyl)butanamide (2S)-2-amino-N-(2-pyrrolidin-1-y…
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) | 0.42 | 3.99 | -48.71 | 4 | 5 | 1 | 73 | 249.338 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.42 | 3.69 | -8.92 | 3 | 5 | 0 | 71 | 248.33 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 4.18 | -87.31 | 5 | 5 | 2 | 74 | 250.346 | 4 | ↓ |