| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2012 | 23 | Yes |
Popular Name: Isotretinoin Isotretinoin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4759-48-2 , [4759-48-2]
| 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) | 6.07 | 11.95 | -55.89 | 0 | 2 | -1 | 40 | 313.461 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 6.07 | 11.4 | -5.8 | 1 | 2 | 0 | 37 | 314.469 | 6 | ↓ |
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