In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 20 | Yes |
Popular Name: N-[[4-[[propyl(2,2,2-trifluoroethyl)amino]methyl]thiazol-2-yl]methyl]cyclopropanamine N-[[4-[[propyl(2,2,2-trifluoroet…
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) | 2.37 | 5.71 | -38.12 | 2 | 3 | 1 | 33 | 308.393 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 4.41 | -3.69 | 1 | 3 | 0 | 28 | 307.385 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.