In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2010 | 9 | No |
Popular Name: Cyclopentanamine, 3-[(aminooxy)methyl]- (9CI) Cyclopentanamine, 3-[(aminooxy)m…
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CAS Number: 301547-03-5
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) | -0.41 | -0.49 | -44.18 | 5 | 3 | 1 | 63 | 131.199 | 2 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-6-O | Plasmodium Falciparum (cluster #6 Of 22), Other | Other | 0 | 0.00 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 0.1 | 1.56 | Functional ≤ 10μM |