In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 16 | Yes |
Popular Name: N-ethyl-4-[(isopropylamino)methyl]-N,2,5-trimethyl-pyrazol-3-amine N-ethyl-4-[(isopropylamino)methy…
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) | 1.37 | 6.41 | -35.3 | 2 | 4 | 1 | 38 | 225.36 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 5.24 | -4.63 | 1 | 4 | 0 | 33 | 224.352 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 6.55 | -87.53 | 3 | 4 | 2 | 39 | 226.368 | 5 | ↓ |