In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 20 | Yes |
Popular Name: (2R)-2-amino-2-cyclopropyl-3-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)propanoic (2R)-2-amino-2-cyclopropyl-3-(1,…
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) | -0.14 | 8.5 | -71.65 | 4 | 4 | 1 | 72 | 275.372 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.14 | 8.24 | -36.84 | 3 | 4 | 0 | 71 | 274.364 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.14 | 6.79 | -35.1 | 3 | 4 | 0 | 71 | 274.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.