| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 21 | Yes |
Popular Name: (1R)-N-ethyl-2,2-dimethyl-3-(1,4-oxazepan-4-yl)-1-phenyl-propan-1-amine (1R)-N-ethyl-2,2-dimethyl-3-(1,4…
| 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) | 3.36 | 7.45 | -38.16 | 2 | 3 | 1 | 29 | 291.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 8.32 | -36.58 | 2 | 3 | 1 | 26 | 291.459 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 8.99 | -100.66 | 3 | 3 | 2 | 30 | 292.467 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
