| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | Yes |
Popular Name: (3S)-1-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-3,4-dihydro-2H-quinolin-3-amine (3S)-1-[(5-chloro-1-methyl-imida…
| 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) | 1.26 | 6.02 | -59.67 | 3 | 4 | 1 | 49 | 277.779 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 5.69 | -7.74 | 2 | 4 | 0 | 47 | 276.771 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 6.38 | -103.2 | 4 | 4 | 2 | 50 | 278.787 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
