In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2005 | 29 | Yes |
Popular Name: (4-ethylpiperazin-1-yl)-[5-[(p-tolylmethyl-tert-butyl-amino)methyl]-2-furyl]-methanone (4-ethylpiperazin-1-yl)-[5-[(p-t…
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) | 3.98 | 12.54 | -99.2 | 2 | 5 | 2 | 42 | 399.579 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 10.3 | -44.33 | 1 | 5 | 1 | 41 | 398.571 | 7 | ↓ |