| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 17 | Yes |
Popular Name: N-[[4-[[ethyl(isopropyl)amino]methyl]thiazol-2-yl]methyl]cyclopropanamine N-[[4-[[ethyl(isopropyl)amino]me…
| 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) | 1.62 | 7.39 | -84.18 | 3 | 3 | 2 | 34 | 255.431 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 3.26 | -3.6 | 1 | 3 | 0 | 28 | 253.415 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 4.56 | -34.71 | 2 | 3 | 1 | 33 | 254.423 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
