In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 22 | Yes |
Popular Name: 2-amino-N-[5-[3-(4-ethylphenoxy)propyl]-1,3,4-thiadiazol-2-yl]acetamide 2-amino-N-[5-[3-(4-ethylphenoxy)…
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) | 1.78 | 4.7 | -62.13 | 4 | 6 | 1 | 92 | 321.426 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 4.32 | -21.79 | 3 | 6 | 0 | 90 | 320.418 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 3.25 | -46.61 | 2 | 6 | -1 | 96 | 319.41 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.60 | 3.63 | -48.53 | 3 | 6 | 0 | 98 | 320.418 | 8 | ↓ |