In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2008 | 28 | No |
Popular Name: N-[(7-chloro-4-oxo-3H-quinazolin-2-yl)methyl]-2-nitro-N-propyl-benzamide N-[(7-chloro-4-oxo-3H-quinazolin…
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) | 2.90 | 11.02 | -20.14 | 1 | 8 | 0 | 112 | 400.822 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.36 | 8.31 | -52.96 | 0 | 8 | -1 | 115 | 399.814 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.