In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 19 | Yes |
Popular Name: N-(2-amino-2-oxo-ethyl)-N-cyclopentyl-3-hydroxy-pyridine-2-carboxamide N-(2-amino-2-oxo-ethyl)-N-cyclop…
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) | 0.46 | 2.18 | -18.24 | 3 | 6 | 0 | 97 | 263.297 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.46 | 2.95 | -43.7 | 3 | 6 | 0 | 101 | 263.297 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.46 | 3.19 | -62.9 | 2 | 6 | -1 | 99 | 262.289 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.