In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | Yes |
Popular Name: 2,4-dichloro-6-[[[(1S)-1-(2,5-difluorophenyl)ethyl]amino]methyl]phenol 2,4-dichloro-6-[[[(1S)-1-(2,5-di…
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) | 4.70 | 7.36 | -45.15 | 3 | 2 | 1 | 37 | 333.185 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.70 | 6.93 | -36.2 | 1 | 2 | -1 | 35 | 331.169 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.70 | 8.11 | -29.05 | 2 | 2 | 0 | 40 | 332.177 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.70 | 6.18 | -4.51 | 2 | 2 | 0 | 32 | 332.177 | 4 | ↓ |