In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 20 | Yes |
Popular Name: 2-(ethylamino)-2-methyl-N-[4-(triazol-2-yl)phenyl]propanamide 2-(ethylamino)-2-methyl-N-[4-(tr…
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) | 1.28 | 4.57 | -51.26 | 3 | 6 | 1 | 76 | 274.348 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 3.35 | -11.8 | 2 | 6 | 0 | 72 | 273.34 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.