In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2009 | 20 | Yes |
Popular Name: 3-methyl-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide 3-methyl-N-[2-(4-methylpiperazin…
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) | 2.72 | 7.38 | -46.59 | 2 | 4 | 1 | 37 | 276.404 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 4.92 | -6.72 | 1 | 4 | 0 | 36 | 275.396 | 4 | ↓ |