In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2009 | 30 | No |
Popular Name: methyl methyl
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) | 1.91 | 0.28 | -25.3 | 6 | 10 | 0 | 165 | 418.402 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 1.35 | -67.35 | 5 | 10 | -1 | 168 | 417.394 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 1.35 | -66.61 | 5 | 10 | -1 | 168 | 417.394 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1999042435A2 | IBM Patent Data |