In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 2-(3-aminopyrazol-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile 2-(3-aminopyrazol-1-yl)-5,6,7,8-…
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) | 1.89 | 6.69 | -11.03 | 2 | 5 | 0 | 81 | 239.282 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 6.41 | -42.69 | 3 | 5 | 1 | 82 | 240.29 | 1 | ↓ |