In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2011 | 13 | Yes |
Popular Name: 3-(2-Aminoethyl)-5-fluoro-1H-indole 3-(2-Aminoethyl)-5-fluoro-1H-indole
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) | 1.07 | 2.63 | -104.56 | 4 | 2 | 2 | 42 | 180.226 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 2.24 | -30.97 | 3 | 2 | 1 | 40 | 179.218 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.