In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2006 | 21 | No |
Popular Name: N-[[3-(2-chlorophenyl)-4,5-dihydroisoxazol-5-yl]methyl]-1-phenyl-methanamine N-[[3-(2-chlorophenyl)-4,5-dihyd…
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) | 3.74 | 9.31 | -47.96 | 2 | 3 | 1 | 38 | 301.797 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.74 | 7.91 | -11.64 | 1 | 3 | 0 | 34 | 300.789 | 5 | ↓ |