| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 44 | No |
| 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) | 3.42 | 10.49 | -25.25 | 2 | 10 | 0 | 111 | 601.748 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 12.76 | -53.85 | 3 | 10 | 1 | 112 | 602.756 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,6,7,12,12b-hexahydro-1H-pyrido[2,1-a]$b-carbolin-4-one](http://zinc12.docking.org/img/rings/471264.gif)
![2-[10-(2-furyl)-4-keto-1-(piperidine-1-carbonyl)-2,3,6,7,12,12b-hexahydro-1H-pyrido[2,1-a]$b-carbolin-3-yl]-N-(2-morpholinoethyl)acetamide](http://zinc12.docking.org/img/rings/476464.gif)