In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 20 | No |
Popular Name: N-(2,5-dimethyl-4-nitro-pyrazol-3-yl)-N',N'-diisopropyl-ethane-1,2-diamine N-(2,5-dimethyl-4-nitro-pyrazol-…
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) | 1.85 | 7.11 | -44.49 | 2 | 7 | 1 | 80 | 284.384 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 5.08 | -6.52 | 1 | 7 | 0 | 79 | 283.376 | 7 | ↓ |