In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2009 | 28 | Yes |
Popular Name: N-[(4S)-chroman-4-yl]-3-isopropyl-2,4-dioxo-1H-quinazoline-7-carboxamide N-[(4S)-chroman-4-yl]-3-isopropy…
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) | 1.43 | 6.42 | -14.94 | 2 | 7 | 0 | 93 | 379.416 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 5.31 | -45.95 | 1 | 7 | -1 | 96 | 378.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.