In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 21 | Yes |
Popular Name: 4-[(1S)-1-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]propyl]phenol 4-[(1S)-1-[[(1S)-1-(3,4-dichloro…
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) | 4.42 | 8.39 | -45.35 | 3 | 2 | 1 | 37 | 325.259 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.42 | 7.39 | -6.9 | 2 | 2 | 0 | 32 | 324.251 | 5 | ↓ |