In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2011 | 20 | Yes |
Popular Name: N-methyl-2-methylsulfonyl-N-(2-piperazin-1-ylethyl)aniline N-methyl-2-methylsulfonyl-N-(2-p…
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) | 0.63 | 2.72 | -43.8 | 2 | 5 | 1 | 57 | 298.432 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.63 | 1.36 | -9.91 | 1 | 5 | 0 | 53 | 297.424 | 5 | ↓ |