In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 21 | No |
Popular Name: (2S)-4-(2-chloro-4-nitro-phenoxy)-2-(cyclopropylamino)butanamide (2S)-4-(2-chloro-4-nitro-phenoxy…
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) | 2.26 | 4.32 | -54.76 | 4 | 7 | 1 | 115 | 314.749 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 3.38 | -11.92 | 3 | 7 | 0 | 110 | 313.741 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.