In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2009 | 20 | No |
Popular Name: 2-[cyclopropyl-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]amino]acetic 2-[cyclopropyl-[2-oxo-2-[(1,3,5-…
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) | -0.97 | 5.71 | -34.97 | 2 | 7 | 0 | 91 | 280.328 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.97 | 3.91 | -53.45 | 1 | 7 | -1 | 90 | 279.32 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.