In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 23 | Yes |
Popular Name: 3-bromo-N-[[(3S)-chroman-3-yl]methyl]-2-hydroxy-5-methyl-benzamide 3-bromo-N-[[(3S)-chroman-3-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) | 4.62 | 7.17 | -11.24 | 2 | 4 | 0 | 59 | 376.25 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.62 | 8.17 | -50.36 | 1 | 4 | -1 | 61 | 375.242 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.