In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 17 | Yes |
Popular Name: N3-[(1S)-1-cyclohexylethyl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[(1S)-1-cyclohexylethyl]-2,5-…
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) | 2.62 | 5.04 | -5.85 | 3 | 4 | 0 | 56 | 236.363 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 5.16 | -24.75 | 4 | 4 | 1 | 57 | 237.371 | 3 | ↓ |