In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (3R)-3-[[(1R)-1-(4-cyanophenyl)ethyl]amino]-3-(2-thienyl)propanoic (3R)-3-[[(1R)-1-(4-cyanophenyl)e…
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 | 9.42 | -35.6 | 2 | 4 | 0 | 81 | 300.383 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 8.42 | -45.4 | 1 | 4 | -1 | 76 | 299.375 | 6 | ↓ |