In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2006 | 26 | Yes |
Popular Name: N-(1-cyclohex-3-enylmethyl)-N-(3-pyridylmethyl)benzo[1,3]dioxole-5-carboxamide N-(1-cyclohex-3-enylmethyl)-N-(3…
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) | 2.76 | 8.91 | -11.64 | 0 | 5 | 0 | 52 | 350.418 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 9.19 | -51.8 | 1 | 5 | 1 | 53 | 351.426 | 5 | ↓ |