In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 31 | Yes |
Popular Name: (2S)-2-[[2-[(4S)-2-amino-4-cyclohexyl-5-oxo-4-phenyl-imidazol-1-yl]acetyl]amino]butanedioic (2S)-2-[[2-[(4S)-2-amino-4-cyclo…
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) | -0.18 | 10.53 | -99.3 | 4 | 10 | -1 | 167 | 429.453 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.18 | 10.52 | -122.44 | 3 | 10 | -2 | 166 | 428.445 | 8 | ↓ |
Lo Low (pH 4.5-6) | -0.18 | 8.55 | -64.68 | 5 | 10 | 0 | 164 | 430.461 | 8 | ↓ |