In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 21 | Yes |
Popular Name: (4-tert-butylpiperazin-1-yl)-(1H-indol-3-yl)methanone (4-tert-butylpiperazin-1-yl)-(1H…
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) | 2.13 | 7.69 | -44.33 | 2 | 4 | 1 | 41 | 286.399 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 5.64 | -13.03 | 1 | 4 | 0 | 39 | 285.391 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.