In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2009 | 18 | No |
Popular Name: chloroBLAH chloroBLAH
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) | 3.01 | 4.55 | -30.02 | 3 | 3 | 1 | 42 | 258.732 | 0 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 4.15 | -7.73 | 2 | 3 | 0 | 41 | 257.724 | 0 | ↓ |
Lo Low (pH 4.5-6) | 3.01 | 5.89 | -99.22 | 4 | 3 | 2 | 47 | 259.74 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5216162; US5281608 | IBM Patent Data |