| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 24 | Yes |
Popular Name: 4-[[[(4S)-6,8-dimethylchroman-4-yl]amino]methyl]-N,N,2,5-tetramethyl-pyrazol-3-amine 4-[[[(4S)-6,8-dimethylchroman-4-…
| 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) | 1.94 | 7.98 | -29.96 | 2 | 5 | 1 | 44 | 329.468 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 7.87 | -7.28 | 1 | 5 | 0 | 42 | 328.46 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 9.12 | -43.1 | 2 | 5 | 1 | 47 | 329.468 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.94 | 9.24 | -103.91 | 3 | 5 | 2 | 48 | 330.476 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
