In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 21 | Yes |
Popular Name: (2S)-N-(4-isopropylthiazol-2-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide (2S)-N-(4-isopropylthiazol-2-yl)…
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) | 2.79 | 5.6 | -11.44 | 2 | 5 | 0 | 63 | 303.387 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 3 | -44.65 | 1 | 5 | -1 | 70 | 302.379 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.