In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: N-[(5-bromo-3-thienyl)methyl]-1-methyl-piperidin-4-amine N-[(5-bromo-3-thienyl)methyl]-1-…
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) | 2.44 | 5.95 | -35.08 | 2 | 2 | 1 | 16 | 290.25 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.44 | 7.14 | -108.84 | 3 | 2 | 2 | 21 | 291.258 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.44 | 4.76 | -42.73 | 2 | 2 | 1 | 20 | 290.25 | 3 | ↓ |