In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 16 | Yes |
Popular Name: (4S)-N-(thiazol-5-ylmethyl)-4,5,6,7-tetrahydrobenzofuran-4-amine (4S)-N-(thiazol-5-ylmethyl)-4,5,…
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 | 5.28 | -43.25 | 2 | 3 | 1 | 43 | 235.332 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.11 | 3.89 | -5.91 | 1 | 3 | 0 | 38 | 234.324 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.