In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 18 | Yes |
Popular Name: (1S)-2-(3-bromophenyl)-1-(3-fluorophenyl)-N-methyl-ethanamine (1S)-2-(3-bromophenyl)-1-(3-fluo…
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) | 4.41 | 9.29 | -49.78 | 2 | 1 | 1 | 17 | 309.202 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.41 | 8.36 | -4.29 | 1 | 1 | 0 | 12 | 308.194 | 4 | ↓ |