| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 20 | No |
Popular Name: (1S)-N-[(2-chloro-5-nitro-phenyl)methyl]-1-(2-pyridyl)ethanamine (1S)-N-[(2-chloro-5-nitro-phenyl…
| 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) | 2.85 | 8.4 | -41.72 | 2 | 5 | 1 | 75 | 292.746 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 7.19 | -7.53 | 1 | 5 | 0 | 71 | 291.738 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
