| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 21 | No |
Popular Name: (3S)-N-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-1,1-dioxo-thiolan-3-amine (3S)-N-[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) | 0.92 | 2.93 | -53.91 | 2 | 5 | 1 | 60 | 311.427 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 0.86 | -14.47 | 1 | 5 | 0 | 59 | 310.419 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 4.09 | -153.97 | 3 | 5 | 2 | 64 | 312.435 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.92 | 2.01 | -66.32 | 2 | 5 | 1 | 63 | 311.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
