In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 19 | Yes |
Popular Name: 5-(4-isopropylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one 5-(4-isopropylpiperazin-1-yl)sul…
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) | 0.41 | 0.19 | -12.87 | 1 | 6 | 0 | 73 | 285.369 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.87 | -1.86 | -46.03 | 0 | 6 | -1 | 77 | 284.361 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 2.35 | -50.78 | 2 | 6 | 1 | 75 | 286.377 | 3 | ↓ |