In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 15 | Yes |
Popular Name: N',N'-dimethyl-N-(4-piperidyl)-N-propyl-ethane-1,2-diamine N',N'-dimethyl-N-(4-piperidyl)-N…
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) | 1.08 | 4.53 | -89.92 | 3 | 3 | 2 | 24 | 215.385 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 2.06 | -38.21 | 2 | 3 | 1 | 23 | 214.377 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5618814 | IBM Patent Data |