In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-5,6,7,8-tetrahydroquinoline-3-carboxamidine 2-(4-ethylpiperazin-1-yl)-5,6,7,…
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) | 1.14 | 4.82 | -34.15 | 4 | 5 | 1 | 71 | 288.419 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 5.87 | -7.33 | 3 | 5 | 0 | 69 | 287.411 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 7.02 | -88.29 | 5 | 5 | 2 | 72 | 289.427 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 8.1 | -33.42 | 4 | 5 | 1 | 70 | 288.419 | 3 | ↓ |