In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 21 | Yes |
Popular Name: 1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-(1H-indol-3-yl)propan-1-one 1-[(3S)-3-(dimethylamino)pyrroli…
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) | 2.29 | 8.67 | -43.98 | 2 | 4 | 1 | 41 | 286.399 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 6.26 | -10.31 | 1 | 4 | 0 | 39 | 285.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.