In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 18 | Yes |
Popular Name: (2R)-N-[(1R)-1-(3-bromo-2-thienyl)ethyl]-1-(1-piperidyl)propan-2-amine (2R)-N-[(1R)-1-(3-bromo-2-thieny…
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) | 3.96 | 8.35 | -32.34 | 2 | 2 | 1 | 16 | 332.331 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.96 | 9.41 | -111.06 | 3 | 2 | 2 | 21 | 333.339 | 5 | ↓ |