In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 19 | Yes |
Popular Name: (2R)-2-cyclopropyl-2-(ethylamino)-3-[(2R)-2-methyl-1,4-oxazepan-4-yl]propanoic (2R)-2-cyclopropyl-2-(ethylamino…
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) | -0.82 | 7.03 | -65.59 | 3 | 5 | 1 | 70 | 271.381 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.82 | 6.75 | -38.32 | 2 | 5 | 0 | 66 | 270.373 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.82 | 5.34 | -31.24 | 2 | 5 | 0 | 69 | 270.373 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.