In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
Popular Name: [5-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-2-furyl]methanamine [5-(3,5-dihydro-2H-1,4-benzoxaze…
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) | 1.69 | 5.53 | -98.55 | 4 | 4 | 2 | 54 | 260.337 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 3.43 | -47.28 | 3 | 4 | 1 | 53 | 259.329 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.