In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 19 | Yes |
Popular Name: N-[[2-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]acetamide N-[[2-[(4-methylpiperazin-1-yl)m…
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) | 0.51 | 5.63 | -43.16 | 2 | 4 | 1 | 37 | 262.377 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 5.57 | -36.36 | 2 | 4 | 1 | 37 | 262.377 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 2.9 | -6.23 | 1 | 4 | 0 | 36 | 261.369 | 4 | ↓ |