| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 19 | Yes |
Popular Name: (3S,4S)-3-(4-methyl-1,4-diazepan-1-yl)chroman-4-amine (3S,4S)-3-(4-methyl-1,4-diazepan…
| 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) | -0.52 | 4.12 | -100.85 | 4 | 4 | 2 | 45 | 263.385 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | 3.81 | -38.6 | 3 | 4 | 1 | 43 | 262.377 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | 1.89 | -3.6 | 2 | 4 | 0 | 42 | 261.369 | 1 | ↓ |
