| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 14 | Yes |
Popular Name: [4-[[(2R)-2-methylpyrrolidin-1-yl]methyl]thiazol-2-yl]methanamine [4-[[(2R)-2-methylpyrrolidin-1-y…
| 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) | 0.56 | 3.4 | -91 | 4 | 3 | 2 | 45 | 213.35 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 0.75 | -6.02 | 2 | 3 | 0 | 42 | 211.334 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.56 | 2.99 | -30.39 | 3 | 3 | 1 | 43 | 212.342 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
