| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 36 | Yes |
Popular Name: [2-methoxy-5-[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]phenyl]methylBLAHone [2-methoxy-5-[(1R)-2,3,4,9-tetra…
| 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) | 4.01 | 12.63 | -55.46 | 3 | 6 | 1 | 63 | 481.62 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.01 | 10.39 | -16.3 | 2 | 6 | 0 | 62 | 480.612 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 13.72 | -119.89 | 4 | 6 | 2 | 68 | 482.628 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 11.48 | -59.96 | 3 | 6 | 1 | 67 | 481.62 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[3-(2,3,4,9-tetrahydro-1H-$b-carbolin-1-yl)benzyl]BLAHone](http://zinc12.docking.org/img/rings/550081.gif)