| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 21 | No |
Popular Name: 3-amino-4-nitro-N-[(1S)-1-(3-pyridyl)ethyl]benzamide 3-amino-4-nitro-N-[(1S)-1-(3-pyr…
| 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) | 1.22 | 4.44 | -10.56 | 3 | 7 | 0 | 114 | 286.291 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 4.93 | -46.26 | 4 | 7 | 1 | 115 | 287.299 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
