In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 17 | Yes |
Popular Name: 2-chloro-N1-methyl-N1-[(1R,2S)-2-methylcyclohexyl]benzene-1,4-diamine 2-chloro-N1-methyl-N1-[(1R,2S)-2…
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) | 3.87 | 6.64 | -2.33 | 2 | 2 | 0 | 29 | 252.789 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.87 | 7.55 | -26.62 | 3 | 2 | 1 | 30 | 253.797 | 2 | ↓ |