In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 16 | Yes |
Popular Name: (2S)-2-[[(3R)-1-isopropylpyrrolidin-3-yl]amino]-4-methyl-pentan-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) | 1.93 | 3.67 | -31.13 | 3 | 3 | 1 | 37 | 229.388 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 4.5 | -104.58 | 4 | 3 | 2 | 41 | 230.396 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 2.09 | -33.09 | 3 | 3 | 1 | 40 | 229.388 | 6 | ↓ |