In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 16 | No |
Popular Name: [6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]methanethiol [6-(4-ethylpiperazin-1-yl)pyrida…
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) | 1.26 | 5.27 | -40.68 | 1 | 4 | 1 | 33 | 239.368 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 3.37 | -46.96 | 0 | 4 | -1 | 32 | 237.352 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 2.89 | -8.05 | 0 | 4 | 0 | 32 | 238.36 | 3 | ↓ |