In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 19 | Yes |
Popular Name: 4-[(3S)-3-amino-3,4-dihydro-2H-quinoline-1-carbonyl]-1,3-dihydroimidazol-2-one 4-[(3S)-3-amino-3,4-dihydro-2H-q…
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) | -0.20 | 0.67 | -76.63 | 5 | 6 | 1 | 97 | 259.289 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.20 | 0.35 | -15.25 | 4 | 6 | 0 | 95 | 258.281 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.