In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 32 | Yes |
Popular Name: [(1S)-1-methylpropyl]-[4-[2-(1-piperidyl)ethyl]piperazin-1-yl]BLAH [(1S)-1-methylpropyl]-[4-[2-(1-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) | 5.52 | 13.88 | -40.24 | 1 | 5 | 1 | 37 | 456.724 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.52 | 16.13 | -128.62 | 2 | 5 | 2 | 38 | 457.732 | 6 | ↓ |