In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 23 | No |
Popular Name: 1-(3-methylbut-2-enyl)-4-(2-nitrophenyl)sulfonyl-piperazine 1-(3-methylbut-2-enyl)-4-(2-nitr…
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) | 2.73 | 6.38 | -20.2 | 0 | 7 | 0 | 86 | 339.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 8.64 | -66.48 | 1 | 7 | 1 | 88 | 340.425 | 5 | ↓ |