In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 19 | No |
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) | 1.81 | -0.83 | -74.51 | 2 | 4 | -1 | 79 | 276.252 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
PPAP-1-E | Prostatic Acid Phosphatase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 4 | 0.62 | Binding ≤ 10μM |
PPAP-1-E | Prostatic Acid Phosphatase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 200 | 0.49 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
PPAP_HUMAN | P15309 | Prostatic Acid Phosphatase, Human | 198 | 0.49 | Binding ≤ 1μM |
PPAP_HUMAN | P15309 | Prostatic Acid Phosphatase, Human | 198 | 0.49 | Binding ≤ 10μM |