In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 17 | Yes |
Popular Name: 2,5-dimethyl-N3-[[(1S,2S)-2-methylcyclohexyl]methyl]pyrazole-3,4-diamine 2,5-dimethyl-N3-[[(1S,2S)-2-meth…
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) | 2.53 | 4.88 | -5.84 | 3 | 4 | 0 | 56 | 236.363 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 5 | -25.38 | 4 | 4 | 1 | 57 | 237.371 | 3 | ↓ |