In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 15 | Yes |
Popular Name: N3,2,5-trimethyl-N3-[(2S)-2-methylbutyl]pyrazole-3,4-diamine N3,2,5-trimethyl-N3-[(2S)-2-meth…
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) | 1.87 | 4.78 | -24.05 | 3 | 4 | 1 | 48 | 211.333 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 4.66 | -5.39 | 2 | 4 | 0 | 47 | 210.325 | 4 | ↓ |