| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2007 | 32 | No |
Popular Name: 4-(bromo-chloro-BLAHylidene)-N-butyl-N'-cyano-piperidine-1-carboxamidine 4-(bromo-chloro-BLAHylidene)-N-b…
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) | 5.99 | 18.72 | -6.05 | 1 | 5 | 0 | 64 | 512.883 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.99 | 18.51 | -46.49 | 2 | 5 | 1 | 66 | 513.891 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.99 | 18.13 | -36.08 | 2 | 5 | 1 | 66 | 513.891 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.99 | 17.98 | -38.03 | 2 | 5 | 1 | 66 | 513.891 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FNTA-1-E | Protein Farnesyltransferase/geranylgeranyltransferase Type I Alpha Subunit (cluster #1 Of 3), Eukaryotic | Eukaryotes | 105 | 0.31 | Binding ≤ 10μM |
| FNTB-1-E | Protein Farnesyltransferase Beta Subunit (cluster #1 Of 3), Eukaryotic | Eukaryotes | 105 | 0.31 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FNTB_HUMAN | P49356 | Protein Farnesyltransferase Beta Subunit, Human | 105 | 0.31 | Binding ≤ 1μM |
| FNTA_HUMAN | P49354 | Protein Farnesyltransferase/geranylgeranyltransferase Type I Alpha Subunit, Human | 105 | 0.31 | Binding ≤ 1μM |
| FNTB_HUMAN | P49356 | Protein Farnesyltransferase Beta Subunit, Human | 105 | 0.31 | Binding ≤ 10μM |
| FNTA_HUMAN | P49354 | Protein Farnesyltransferase/geranylgeranyltransferase Type I Alpha Subunit, Human | 105 | 0.31 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Apoptotic cleavage of cellular proteins | |
| Inactivation, recovery and regulation of the phototransduction cascade |
