In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 17 | Yes |
Popular Name: (3,4-diaminophenyl)-(4-methylpiperazin-1-yl)methanone (3,4-diaminophenyl)-(4-methylpip…
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) | -0.31 | 2.32 | -46.63 | 5 | 5 | 1 | 77 | 235.311 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.31 | -0.08 | -12.23 | 4 | 5 | 0 | 76 | 234.303 | 1 | ↓ |