In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 27 | Yes |
Popular Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-N-[(1-morpholinocyclohexyl)methyl]benzamide 2-(2-amino-2-oxo-ethyl)sulfanyl-…
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) | 2.10 | 3.01 | -17.61 | 3 | 6 | 0 | 85 | 391.537 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 4.97 | -49.83 | 4 | 6 | 1 | 86 | 392.545 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.