In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 18 | Yes |
Popular Name: N3-[(1S)-1-cyclohexylpropyl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[(1S)-1-cyclohexylpropyl]-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) | 3.15 | 5.77 | -4.41 | 3 | 4 | 0 | 56 | 250.39 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.15 | 5.9 | -24.85 | 4 | 4 | 1 | 57 | 251.398 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.