In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
Popular Name: (2R)-2-phenyl-2-[(1,2,5-trimethylpyrrol-3-yl)methylamino]ethanol (2R)-2-phenyl-2-[(1,2,5-trimethy…
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) | 1.80 | 6.46 | -35.49 | 3 | 3 | 1 | 42 | 259.373 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.80 | 5.33 | -7.08 | 2 | 3 | 0 | 37 | 258.365 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.