In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | Yes |
Popular Name: 4-bromo-N1-methyl-N1-(3-pyridylmethyl)benzene-1,2-diamine 4-bromo-N1-methyl-N1-(3-pyridylm…
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) | 2.42 | 6.41 | -4.06 | 2 | 3 | 0 | 42 | 292.18 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.42 | 6.87 | -33.86 | 3 | 3 | 1 | 43 | 293.188 | 3 | ↓ |