In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2005 | 30 | Yes |
Popular Name: N-[4-dimethylamino-3-(3-pyridylmethylcarbamoyl)phenyl]-3,5,5-trimethyl-hexanamide N-[4-dimethylamino-3-(3-pyridylm…
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) | 3.49 | -0.77 | -13.5 | 2 | 6 | 0 | 74 | 410.562 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.49 | -0.65 | -47.88 | 3 | 6 | 1 | 75 | 411.57 | 9 | ↓ |