In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 19 | Yes |
Popular Name: 3-[[(1R,2R,4S)-norbornan-2-yl]methyl]-4-(2-thienyl)isoxazol-5-amine 3-[[(1R,2R,4S)-norbornan-2-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) | 3.87 | 6.2 | -5.67 | 2 | 3 | 0 | 52 | 274.389 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.87 | 6.13 | -28.39 | 3 | 3 | 1 | 53 | 275.397 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.