In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 17 | Yes |
Popular Name: N-[(5-bromo-3-thienyl)methyl]-1-propyl-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) | 3.32 | 7.35 | -34.82 | 2 | 2 | 1 | 16 | 318.304 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 8.54 | -111.11 | 3 | 2 | 2 | 21 | 319.312 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 6.32 | -42.75 | 2 | 2 | 1 | 20 | 318.304 | 5 | ↓ |