In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2005 | 21 | Yes |
Popular Name: 29429-03-6; 3,12-Didehydro-9-methoxygalanthan-1alpha,2beta,10-triol; C12187; Pseudolycorine 29429-03-6; 3,12-Didehydro-9-met…
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CAS Number: 29429-03-6
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) | -0.01 | -5.83 | -44.27 | 4 | 5 | 1 | 74 | 290.339 | 1 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80682-1-O | A549 (Lung Carcinoma Cells) (cluster #1 Of 11), Other | Other | 7500 | 0.34 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80682 | Z80682 | A549 (Lung Carcinoma Cells) | 7400 | 0.34 | Functional ≤ 10μM |