In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 20 | Yes |
Popular Name: 5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)furan-3-carboxylic 5-(1,3,4,5-tetrahydro-2-benzazep…
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) | 2.41 | 9.85 | -66.19 | 1 | 4 | 0 | 58 | 271.316 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 7.76 | -52.11 | 0 | 4 | -1 | 57 | 270.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.