In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 10th, 2011 | 25 | Yes |
4429-63-4; C09244; Tabersonine
CHEBI:15192; CHEBI:20636; CHEBI:9387
tabersonine; tabersonine cation; tabersonine(1+); tabersoninium; tabersoninium cation
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) | 3.69 | 8.05 | -5.67 | 1 | 4 | 0 | 42 | 336.435 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
UniProt Database Links | DAT_CATRO; DV4H_CATRO; HTOMT_CATRO | ChEBI |
PUBCHEM_PATENT_ID | EP0021923A1; EP0050562A1; EP0098234A2; EP0378921A2; EP0491549A1; EP0491549B1; US3892755; US3979395; US4145552; US4152519; US4285949; US4316029; US4400249; US4569914; US5030573; US5204355; WO1988000968A2; WO2000007437A1 | IBM Patent Data |