| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 15 | No |
Popular Name: (1S,2R)-N1-(4-methyl-3-nitro-phenyl)cyclopropane-1,2-diamine (1S,2R)-N1-(4-methyl-3-nitro-phe…
| 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) | 1.64 | 3.85 | -52.25 | 4 | 5 | 1 | 85 | 208.241 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 3.55 | -7.42 | 3 | 5 | 0 | 84 | 207.233 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
