In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2011 | 28 | No |
Popular Name: N-(2-dimethylaminoethyl)-N-[(3-fluorophenyl)methyl]-5-nitro-1H-indazole-3-carboxamide N-(2-dimethylaminoethyl)-N-[(3-f…
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) | 2.81 | 10.89 | -65.37 | 2 | 8 | 1 | 99 | 386.407 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 10.75 | -51.11 | 1 | 8 | 0 | 98 | 385.399 | 7 | ↓ |