| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 21 | Yes |
Popular Name: Efavirenz Efavirenz
Find On: PubMed — Wikipedia — Google
CAS Numbers: 154598-52-4 , 154801-74-8
6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-2-one
| 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) | 4.53 | 7.44 | -10.04 | 1 | 3 | 0 | 38 | 315.678 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.16 | 4.87 | -45.08 | 0 | 3 | -1 | 45 | 314.67 | 1 | ↓ |
