In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | Yes |
Popular Name: (1S)-N-cyclohexyl-N-ethyl-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine (1S)-N-cyclohexyl-N-ethyl-1-(1-m…
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) | 1.39 | 3.69 | -48.57 | 3 | 4 | 1 | 49 | 251.398 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 5.66 | -126.79 | 4 | 4 | 2 | 50 | 252.406 | 5 | ↓ |