In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 22 | Yes |
Popular Name: 3-(5-benzyloxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoic 3-(5-benzyloxycarbonyl-2,4-dimet…
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) | 2.99 | 9.2 | -51.91 | 1 | 5 | -1 | 82 | 300.334 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |