In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: 2-(3-aminopyrazol-1-yl)-1-[4-[(1S)-1-methylpropyl]piperazin-1-yl]ethanone 2-(3-aminopyrazol-1-yl)-1-[4-[(1…
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) | 0.44 | 5.27 | -49.51 | 3 | 6 | 1 | 69 | 266.369 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 3.45 | -15.57 | 2 | 6 | 0 | 67 | 265.361 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.