In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 17 | Yes |
Popular Name: N3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[[(2R)-1-ethylpyrrolidin-2-yl…
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) | 0.80 | 4.45 | -39.04 | 4 | 5 | 1 | 60 | 238.359 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 2.33 | -6.22 | 3 | 5 | 0 | 59 | 237.351 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 4.58 | -81.59 | 5 | 5 | 2 | 62 | 239.367 | 4 | ↓ |