In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 20 | Yes |
Popular Name: 2-[(1S)-1-[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]ethyl]-4-methoxy-phenol 2-[(1S)-1-[[(3S)-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) | 2.54 | 3.14 | -38.39 | 3 | 4 | 1 | 49 | 277.388 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.54 | 2.17 | -4.5 | 2 | 4 | 0 | 45 | 276.38 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 4.52 | -32.87 | 3 | 4 | 1 | 46 | 277.388 | 5 | ↓ |