In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 26 | No |
Popular Name: N-ethyl-2-nitro-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide N-ethyl-2-nitro-N-[(4-oxo-3H-qui…
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) | 1.74 | 9.76 | -22.94 | 1 | 8 | 0 | 112 | 352.35 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 7.04 | -58.86 | 0 | 8 | -1 | 115 | 351.342 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.