In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 15 | Yes |
Popular Name: (3R)-3-[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]butanoic (3R)-3-[[(3S)-1-cyclopropylpyrro…
None
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) | 0.46 | 5.59 | -53.06 | 2 | 4 | 0 | 57 | 212.293 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.46 | 3.25 | -46.75 | 1 | 4 | -1 | 55 | 211.285 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.46 | 4.04 | -34.07 | 2 | 4 | 0 | 60 | 212.293 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.46 | 6.38 | -81.39 | 3 | 4 | 1 | 61 | 213.301 | 5 | ↓ |