| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: 4-(ethylaminomethyl)-N,2,5-trimethyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyrazol-3-amine 4-(ethylaminomethyl)-N,2,5-trime…
| 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) | 1.07 | 6.2 | -38.68 | 2 | 5 | 1 | 47 | 267.397 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 4.81 | -4.97 | 1 | 5 | 0 | 42 | 266.389 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 6.33 | -91.75 | 3 | 5 | 2 | 48 | 268.405 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
