In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 19 | Yes |
Popular Name: 2-[(1S)-1-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]ethyl]benzene-1,4-diol 2-[(1S)-1-[[(3R)-1-cyclopropylpy…
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) | 2.01 | 0.77 | -40.21 | 4 | 4 | 1 | 60 | 263.361 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 3.06 | -109.87 | 5 | 4 | 2 | 61 | 264.369 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 2.17 | -35.07 | 4 | 4 | 1 | 57 | 263.361 | 4 | ↓ |