In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 34 | Yes |
Popular Name: dimethyl-(4-methylpiperazin-1-yl)-methylsulfanyl-morpholino-BLAH dimethyl-(4-methylpiperazin-1-yl…
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) | 4.25 | 8.9 | -44.04 | 1 | 8 | 1 | 68 | 501.702 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 6.42 | -8.46 | 0 | 8 | 0 | 67 | 500.694 | 3 | ↓ |