In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 18 | No |
Popular Name: (4S)-N-(1-methylpyrazol-4-yl)-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-(1-methylpyrazol-4-yl)-4-…
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) | 2.05 | 6.72 | -31.18 | 2 | 4 | 1 | 44 | 259.358 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 6.28 | -9.85 | 1 | 4 | 0 | 42 | 258.35 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.