In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2010 | 29 | Yes |
Popular Name: 1-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-2-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile 1-[(3S)-3-(dimethylamino)pyrroli…
None
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) | 4.61 | 15.5 | -58.09 | 1 | 5 | 1 | 49 | 382.491 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.61 | 13.1 | -11.51 | 0 | 5 | 0 | 48 | 381.483 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.