In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 20 | No |
Popular Name: [6-(4-phenylpiperazin-1-yl)pyridazin-3-yl]methanethiol [6-(4-phenylpiperazin-1-yl)pyrid…
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) | 2.58 | 5.71 | -9.17 | 0 | 4 | 0 | 32 | 286.404 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 6.19 | -47.73 | 0 | 4 | -1 | 32 | 285.396 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.58 | 5.79 | -34.81 | 1 | 4 | 1 | 34 | 287.412 | 3 | ↓ |