In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 20 | Yes |
Popular Name: 3-[(4S)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl]-1H-quinolin-2-one 3-[(4S)-4,5,6,7-tetrahydro-1H-im…
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) | 0.93 | 4.97 | -40.32 | 4 | 5 | 1 | 78 | 267.312 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 3.65 | -12.67 | 3 | 5 | 0 | 74 | 266.304 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.