| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 20 | Yes |
Popular Name: (5-amino-1H-indol-3-yl)-(4-methyl-1,4-diazepan-1-yl)methanone (5-amino-1H-indol-3-yl)-(4-methy…
| 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) | 0.27 | 5.44 | -44.18 | 4 | 5 | 1 | 67 | 273.36 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.27 | 3.42 | -15.42 | 3 | 5 | 0 | 65 | 272.352 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
