In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: (5-amino-1H-indol-3-yl)-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]methanone (5-amino-1H-indol-3-yl)-[(3R)-3-…
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) | 0.26 | 4.55 | -50.84 | 4 | 5 | 1 | 67 | 273.36 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.26 | 2.16 | -17.07 | 3 | 5 | 0 | 65 | 272.352 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.