In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
Popular Name: (1R)-1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)thiazol-5-yl]ethanamine (1R)-1-[2-(3,5-dihydro-2H-1,4-be…
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) | 0.47 | 5.23 | -46.66 | 3 | 4 | 1 | 53 | 276.385 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.47 | 4.89 | -8.24 | 2 | 4 | 0 | 51 | 275.377 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.