In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 14 | Yes |
Popular Name: (1R)-1-cyclopropyl-2-[(2R)-2-methyl-1,4-oxazepan-4-yl]ethanamine (1R)-1-cyclopropyl-2-[(2R)-2-met…
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) | 0.56 | 3.15 | -40.47 | 3 | 3 | 1 | 40 | 199.318 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 4.72 | -122.4 | 4 | 3 | 2 | 41 | 200.326 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.