| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 19 | Yes |
Popular Name: 3-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)pyridin-2-amine 3-(1,3,4,5-tetrahydro-2-benzazep…
| 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) | 2.19 | 8.04 | -39.3 | 3 | 3 | 1 | 43 | 254.357 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 6.34 | -31.03 | 3 | 3 | 1 | 43 | 254.357 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 5.87 | -5.5 | 2 | 3 | 0 | 42 | 253.349 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 8.51 | -98.66 | 4 | 3 | 2 | 45 | 255.365 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
