In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2009 | 34 | Yes |
Popular Name: 5-(3,3-dimethylbutanoylamino)-1-phenethyl-N-phenyl-indole-2-carboxamide 5-(3,3-dimethylbutanoylamino)-1-…
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) | 6.29 | 14.24 | -16.08 | 2 | 5 | 0 | 63 | 453.586 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
ECE1-1-E | Endothelin-converting Enzyme 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5100 | 0.22 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
ECE1_HUMAN | P42892 | Endothelin-converting Enzyme 1, Human | 5100 | 0.22 | Binding ≤ 10μM |