In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | Yes |
Popular Name: 4-[[(1R)-1-(5-ethyl-2-thienyl)ethyl]amino]-3-methyl-benzoic 4-[[(1R)-1-(5-ethyl-2-thienyl)et…
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) | 4.73 | 9.86 | -51.72 | 1 | 3 | -1 | 52 | 288.392 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.73 | 7.88 | -7.31 | 2 | 3 | 0 | 49 | 289.4 | 5 | ↓ |