| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2010 | 34 | Yes |
Popular Name: geneticin geneticin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 108321-42-2 , 49863-47-0
49863-47-0; Antibiotic G-418; C17703; G418; Geneticin
Antibiotic G-418, sulfate (salt); G-418 sulfate; LS-21061
| 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) | -5.17 | -14.38 | -297.31 | 17 | 14 | 4 | 258 | 500.59 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.17 | -16.74 | -8.89 | 13 | 14 | 0 | 248 | 496.558 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.17 | -15.84 | -52.16 | 14 | 14 | 1 | 250 | 497.566 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.17 | -16.02 | -136.25 | 15 | 14 | 2 | 252 | 498.574 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.17 | -14.2 | -178.38 | 16 | 14 | 3 | 256 | 499.582 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.17 | -14.75 | -200.17 | 16 | 14 | 3 | 256 | 499.582 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0194626A2; EP0213894A2; EP0232544A2; EP0255694A1; EP0260148A2; EP0271003A2; EP0272928A2; EP0272928B1; EP0277313A1; EP0277313B1; EP0278776A2; EP0278776B1; EP0303028A1; EP0306968A2; EP0306968B1; EP0307247A2; EP0307247B1; EP0307248A2; EP0307248B1; EP030871 | IBM Patent Data |
| H phrase | H334: May cause allergy or asthma symptoms or breathing difficulties if inhaled | Acros Organics |
| H phrase | H334: May cause allergy or asthma symptoms or breathing difficulties if inhaled; H317: May cause an allergic skin reaction; H360FD: May damage fertility. May damage the unborn child | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P304 + P341: IF INHALED: If breathing is difficult, remove to fresh air and keep at rest in a position comfortable for breathing; P342 + P311: If experiencing respiratory symptoms: Call a POISON CENTE | Acros Organics |
| R phrase | R60: May impair fertility. | Acros Organics |
| R phrase | R60: May impair fertility.; R61: May cause harm to the unborn child.; R42/43: May cause sensitisation by inhalation and skin contact. | Acros Organics |
| S phrase | S53: Avoid exposure - obtain special instructions before use. | Acros Organics |
| S phrase | S53: Avoid exposure - obtain special instructions before use.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case | Acros Organics |
| Hazard | T: Toxic | Acros Organics |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50676-2-O | Dengue Virus (cluster #2 Of 2), Other | Other | 6000 | 0.22 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50676 | Z50676 | Dengue Virus | 4000 | 0.22 | Functional ≤ 10μM |
