In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 17 | Yes |
Popular Name: [2-(3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]methanamine [2-(3,4-dihydro-2H-quinolin-1-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) | 2.73 | 6.53 | -49.23 | 3 | 3 | 1 | 44 | 246.359 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 6.13 | -7.76 | 2 | 3 | 0 | 42 | 245.351 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.