In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2006 | 29 | Yes |
Popular Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-3-(2-furylmethylaminomethyl)indole-2-carboxylic 1-[(2-chloro-4-fluoro-phenyl)met…
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) | 4.55 | 12.35 | -35.23 | 2 | 5 | 0 | 75 | 412.848 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.55 | 10.98 | -46.03 | 1 | 5 | -1 | 70 | 411.84 | 7 | ↓ |