| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 16 | Yes |
Popular Name: N-[(3,5-dimethylisoxazol-4-yl)methyl]-1-(3-methyl-1H-pyrazol-4-yl)methanamine N-[(3,5-dimethylisoxazol-4-yl)me…
| 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) | 0.28 | 3.57 | -55.95 | 3 | 5 | 1 | 71 | 221.284 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 2.21 | -11.25 | 2 | 5 | 0 | 67 | 220.276 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 2.24 | -10.85 | 2 | 5 | 0 | 67 | 220.276 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 3.61 | -54.61 | 3 | 5 | 1 | 71 | 221.284 | 4 | ↓ |
