In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 29th, 2008 | 32 | Yes |
Popular Name: 2-(4-benzylpiperazin-1-yl)-N-[(1S)-1-(methoxymethyl)propyl]quinoline-4-carboxamide 2-(4-benzylpiperazin-1-yl)-N-[(1…
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) | 3.95 | 9.45 | -9.63 | 1 | 6 | 0 | 58 | 432.568 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 11.67 | -49.48 | 2 | 6 | 1 | 59 | 433.576 | 8 | ↓ |