In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
Popular Name: (1S)-1-cyclopropyl-N-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]ethanamine (1S)-1-cyclopropyl-N-[2-(3,5-dih…
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) | 2.60 | 8.15 | -121.24 | 3 | 3 | 2 | 30 | 262.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 6.07 | -41.9 | 2 | 3 | 1 | 29 | 261.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.