In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 13 | Yes |
Popular Name: (1S)-1-[2-[(2S)-tetrahydrofuran-2-yl]thiazol-4-yl]ethanamine (1S)-1-[2-[(2S)-tetrahydrofuran-…
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) | -0.95 | 1.29 | -45.34 | 3 | 3 | 1 | 50 | 199.299 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.95 | 0.96 | -6.04 | 2 | 3 | 0 | 48 | 198.291 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.