In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 16 | No |
Popular Name: 5-(4-tert-butylpiperazin-1-yl)-1,3,4-thiadiazole-2-thiol 5-(4-tert-butylpiperazin-1-yl)-1…
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) | 2.35 | 6.23 | -61.65 | 1 | 4 | 0 | 33 | 258.416 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 4.16 | -40.92 | 0 | 4 | -1 | 32 | 257.408 | 2 | ↓ |