In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 18 | Yes |
Popular Name: 3-[(4-propylpiperazin-1-yl)methyl]furan-2-carboxylic 3-[(4-propylpiperazin-1-yl)methy…
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) | 1.27 | 6.31 | -59.95 | 1 | 5 | 0 | 61 | 252.314 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.27 | 4.04 | -50.77 | 0 | 5 | -1 | 60 | 251.306 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 6.13 | -39.88 | 1 | 5 | 0 | 61 | 252.314 | 5 | ↓ |