In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | Yes |
Popular Name: N-[[2-(ethylaminomethyl)thiazol-4-yl]methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine N-[[2-(ethylaminomethyl)thiazol-…
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) | 1.87 | 4.59 | -37.96 | 2 | 3 | 1 | 33 | 294.366 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 3.22 | -7.68 | 1 | 3 | 0 | 28 | 293.358 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 6.32 | -92.12 | 3 | 3 | 2 | 34 | 295.374 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.