In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2012 | 27 | Yes |
Popular Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-(8-quinolyl)benzamide 4-[(4-methylpiperazin-1-yl)methy…
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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) | 2.48 | 8.41 | -44.4 | 2 | 5 | 1 | 50 | 361.469 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.48 | 6.04 | -11.1 | 1 | 5 | 0 | 48 | 360.461 | 4 | ↓ |