In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 24 | Yes |
Popular Name: 6-[2-[(4-allyl-5-amino-1,2,4-triazol-3-yl)sulfanyl]ethoxy]-3,4-dihydro-1H-quinolin-2-one 6-[2-[(4-allyl-5-amino-1,2,4-tri…
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) | 2.17 | 8.28 | -16.82 | 3 | 7 | 0 | 95 | 345.428 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.