In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 20 | Yes |
Popular Name: 2-[[5-(4-tert-butylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic 2-[[5-(4-tert-butylpiperazin-1-y…
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) | 1.80 | 7.58 | -70.33 | 1 | 6 | 0 | 74 | 316.452 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 5.51 | -44.23 | 0 | 6 | -1 | 72 | 315.444 | 5 | ↓ |