In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 20 | Yes |
Popular Name: 2-bromo-4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methyl]-6-methoxy-phenol 2-bromo-4-[[[(2S)-1-ethylpyrroli…
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) | 2.60 | 6.36 | -127.77 | 4 | 4 | 2 | 51 | 345.281 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 5.74 | -63.9 | 2 | 4 | 0 | 49 | 343.265 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 5 | -37.11 | 3 | 4 | 1 | 46 | 344.273 | 6 | ↓ |