In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2011 | 21 | Yes |
Popular Name: (4-tert-butylpiperazin-1-yl)-(2H-indazol-3-yl)methanone (4-tert-butylpiperazin-1-yl)-(2H…
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) | 2.38 | 4.86 | -9.28 | 1 | 5 | 0 | 52 | 286.379 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 6.88 | -38.06 | 2 | 5 | 1 | 53 | 287.387 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.