In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 20 | Yes |
Popular Name: 2-chloro-4-[4-methyl-5-[(1R)-1-(propylamino)ethyl]thiazol-2-yl]phenol 2-chloro-4-[4-methyl-5-[(1R)-1-(…
None
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) | 4.63 | 5.84 | -43.09 | 3 | 3 | 1 | 50 | 311.858 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.63 | 5.39 | -38.34 | 1 | 3 | -1 | 48 | 309.842 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.63 | 4.62 | -5.89 | 2 | 3 | 0 | 45 | 310.85 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.63 | 6.62 | -64.94 | 2 | 3 | 0 | 53 | 310.85 | 5 | ↓ |