| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 22 | Yes |
Popular Name: 4-[[[(1S)-4-chloroindan-1-yl]amino]methyl]-N,N,2,5-tetramethyl-pyrazol-3-amine 4-[[[(1S)-4-chloroindan-1-yl]ami…
| 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) | 2.80 | 8.32 | -29.58 | 2 | 4 | 1 | 34 | 319.86 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 8.21 | -6.59 | 1 | 4 | 0 | 33 | 318.852 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 9.36 | -43.23 | 2 | 4 | 1 | 38 | 319.86 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 9.45 | -103.62 | 3 | 4 | 2 | 39 | 320.868 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
