In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 23 | No |
Popular Name: 4-Oxo-isotretinoin 4-Oxo-isotretinoin
Find On: PubMed — Wikipedia — Google
CAS Number: 71748-58-8
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) | 4.47 | 11.26 | -62.61 | 0 | 3 | -1 | 57 | 313.417 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.47 | 10.16 | -14.64 | 1 | 3 | 0 | 54 | 314.425 | 5 | ↓ |