In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 19 | Yes |
Popular Name: N-butyl-N-ethyl-4-[(isopropylamino)methyl]-2,5-dimethyl-pyrazol-3-amine N-butyl-N-ethyl-4-[(isopropylami…
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) | 2.81 | 8.78 | -36.53 | 2 | 4 | 1 | 38 | 267.441 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 7.54 | -4.22 | 1 | 4 | 0 | 33 | 266.433 | 8 | ↓ |