In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 10th, 2006 | 27 | No |
Popular Name: N-isopropyl-3-nitro-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide N-isopropyl-3-nitro-N-[(4-oxo-3H…
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) | 2.06 | 9.3 | -21.89 | 1 | 8 | 0 | 112 | 366.377 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 6.32 | -53.54 | 0 | 8 | -1 | 115 | 365.369 | 5 | ↓ |