In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: (2R,3S)-2-amino-3-methyl-N-(2-pyrrolidin-1-yl-3-pyridyl)pentanamide (2R,3S)-2-amino-3-methyl-N-(2-py…
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) | 1.16 | 5.18 | -49.27 | 4 | 5 | 1 | 73 | 277.392 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.16 | 4.86 | -10.12 | 3 | 5 | 0 | 71 | 276.384 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.16 | 5.44 | -88.92 | 5 | 5 | 2 | 74 | 278.4 | 5 | ↓ |