| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 21 | Yes |
Popular Name: [1-[[1-[(1S)-1-methylpropyl]pyrazol-3-yl]methyl]indol-4-yl]methanamine [1-[[1-[(1S)-1-methylpropyl]pyra…
| 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) | 2.89 | 7.88 | -45.55 | 3 | 4 | 1 | 50 | 283.399 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 7.48 | -9.87 | 2 | 4 | 0 | 49 | 282.391 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
