In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2010 | 19 | No |
Popular Name: (5R)-N-[(2-methylthiazol-4-yl)methyl]-5-phenyl-4,5-dihydrothiazol-2-amine (5R)-N-[(2-methylthiazol-4-yl)me…
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) | 2.26 | 6.75 | -29.58 | 2 | 3 | 1 | 39 | 290.437 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 6.8 | -29.33 | 2 | 3 | 1 | 39 | 290.437 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 5.85 | -8.6 | 1 | 3 | 0 | 37 | 289.429 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.