In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 1-[(2S)-2-[[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]propyl]pyrrolidin-2-one 1-[(2S)-2-[[(4S)-1-methyl-4,5,6,…
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) | 0.06 | 6.5 | -42.31 | 2 | 5 | 1 | 55 | 277.392 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.06 | 5.42 | -11.31 | 1 | 5 | 0 | 50 | 276.384 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.06 | 6.67 | -106.42 | 3 | 5 | 2 | 56 | 278.4 | 4 | ↓ |