In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 16 | Yes |
Popular Name: 2-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]ethanamine 2-[5-(phenoxymethyl)-1,3,4-thiad…
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) | 0.63 | 2.67 | -55.14 | 3 | 4 | 1 | 63 | 236.32 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.63 | 2.28 | -9.15 | 2 | 4 | 0 | 61 | 235.312 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.