In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 17 | Yes |
Popular Name: (1S,3R)-3-(4-cyclopropylphenyl)-2,2-dimethyl-cyclopropanecarboxylic (1S,3R)-3-(4-cyclopropylphenyl)-…
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) | 2.68 | 10.1 | -48.29 | 0 | 2 | -1 | 40 | 229.299 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.68 | 8.18 | -5.84 | 1 | 2 | 0 | 37 | 230.307 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4264606 | IBM Patent Data |