In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: (1R)-N-methyl-1-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)thiazol-5-yl]ethanamine (1R)-N-methyl-1-[2-(6-methyl-3,4…
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) | 4.08 | 9.62 | -41.93 | 2 | 3 | 1 | 33 | 288.44 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.08 | 8.35 | -7.36 | 1 | 3 | 0 | 28 | 287.432 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.