In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: 4-[[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]benzonitrile 4-[[(4S)-1-methyl-4,5,6,7-tetrah…
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) | 2.33 | 6.63 | -10.48 | 1 | 4 | 0 | 54 | 252.321 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 7.06 | -38.95 | 2 | 4 | 1 | 55 | 253.329 | 2 | ↓ |