In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 20 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-1-(4-pyrrolidin-1-ylphenyl)methanamine N-[(5-bromo-2-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) | 4.23 | 9.81 | -45.25 | 2 | 2 | 1 | 20 | 352.321 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.23 | 8.46 | -3.86 | 1 | 2 | 0 | 15 | 351.313 | 5 | ↓ |