In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2011 | 21 | No |
Popular Name: 2-[cyanomethyl(cyclopropyl)amino]-N-[(2-methoxyphenyl)methyl]-N-methyl-acetamide 2-[cyanomethyl(cyclopropyl)amino…
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) | 1.25 | 6.81 | -15.36 | 0 | 5 | 0 | 57 | 287.363 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.25 | 9.47 | -43.88 | 1 | 5 | 1 | 58 | 288.371 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.