| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 20 | Yes |
Popular Name: (3S)-1-[(2-isopropylthiazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-amine (3S)-1-[(2-isopropylthiazol-4-yl…
| 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) | 2.23 | 6.7 | -53.94 | 3 | 3 | 1 | 44 | 288.44 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 6.38 | -6.43 | 2 | 3 | 0 | 42 | 287.432 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
