In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 16 | Yes |
Popular Name: 1,3-Benzenediol, 4-[[[(tetrahydro-2-furanyl)methyl]amino]methyl]- (9CI) 1,3-Benzenediol, 4-[[[(tetrahydr…
Find On: PubMed — Wikipedia — Google
CAS Number: 364365-77-5
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) | 1.31 | -0.04 | -39.63 | 4 | 4 | 1 | 66 | 224.28 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 0.73 | -36.79 | 3 | 4 | 0 | 69 | 223.272 | 4 | ↓ |