| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: N-(4-aminophenyl)-3-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]propanamide N-(4-aminophenyl)-3-[(3S)-3-(dim…
| 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) | 0.64 | 3.21 | -39.38 | 4 | 5 | 1 | 63 | 277.392 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.64 | 3.2 | -42.34 | 4 | 5 | 1 | 63 | 277.392 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.64 | 0.83 | -8.78 | 3 | 5 | 0 | 62 | 276.384 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.64 | 5.59 | -110.56 | 5 | 5 | 2 | 64 | 278.4 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
