In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 20 | Yes |
Popular Name: (1R,2S)-N-ethyl-2-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)cyclopentanamine (1R,2S)-N-ethyl-2-(1,3,4,5-tetra…
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) | 3.68 | 8.52 | -39.29 | 2 | 2 | 1 | 20 | 273.444 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 10.52 | -110.09 | 3 | 2 | 2 | 21 | 274.452 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.