In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (2S)-6-[[(2S,6R)-2,6-dimethylcyclohexyl]amino]-2-methyl-4H-1,4-benzoxazin-3-one (2S)-6-[[(2S,6R)-2,6-dimethylcyc…
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) | 4.24 | 6.16 | -5.46 | 2 | 4 | 0 | 50 | 288.391 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | 5.8 | -41.45 | 3 | 4 | 1 | 55 | 289.399 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.