In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 14 | Yes |
Popular Name: (2S)-2-[[(3R)-1-isopropylpyrrolidin-3-yl]amino]butan-1-ol (2S)-2-[[(3R)-1-isopropylpyrroli…
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) | 1.15 | 2.34 | -30.68 | 3 | 3 | 1 | 37 | 201.334 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.15 | 0.83 | -32.04 | 3 | 3 | 1 | 40 | 201.334 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.15 | 3.24 | -101.3 | 4 | 3 | 2 | 41 | 202.342 | 5 | ↓ |