In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2010 | 22 | No |
Popular Name: HTF 919 HTF 919
None
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) | 2.26 | 5.86 | -33.41 | 6 | 6 | 1 | 100 | 302.402 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 5.71 | -13.68 | 5 | 6 | 0 | 99 | 301.394 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 5.72 | -13.96 | 5 | 6 | 0 | 99 | 301.394 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP1003540A1; EP1019360A1; WO1999064044A1; WO1999064055A1; WO1999066944A1; WO2000010526A2; WO2000064441A2; WO2000076500A2 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.