| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 16 | Yes |
Popular Name: 4-[5-[(1S)-1-aminoethyl]-4-methyl-thiazol-2-yl]piperazin-2-one 4-[5-[(1S)-1-aminoethyl]-4-methy…
| 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) | -1.11 | 0.82 | -48.19 | 4 | 5 | 1 | 73 | 241.34 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.11 | 0.49 | -9.2 | 3 | 5 | 0 | 71 | 240.332 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
