In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: (1S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-1-phenyl-butan-1-amine (1S)-N-[(1S)-1-(3,4-dichlorophen…
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) | 5.46 | 12.04 | -42.91 | 2 | 1 | 1 | 17 | 323.287 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.46 | 11.06 | -3 | 1 | 1 | 0 | 12 | 322.279 | 6 | ↓ |