In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 18 | Yes |
Popular Name: (1S)-N,N-dimethyl-2-piperazin-1-yl-1-(p-tolyl)ethanamine (1S)-N,N-dimethyl-2-piperazin-1-…
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) | 1.70 | 6.15 | -92.87 | 3 | 3 | 2 | 24 | 249.402 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 4.74 | -35.9 | 2 | 3 | 1 | 20 | 248.394 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 4.06 | -41.16 | 2 | 3 | 1 | 23 | 248.394 | 4 | ↓ |