In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 18 | No |
Popular Name: 4-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)thiadiazol-5-amine 4-(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) | 2.09 | 5.18 | -41.92 | 3 | 4 | 1 | 56 | 261.374 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 3.09 | -9.9 | 2 | 4 | 0 | 55 | 260.366 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.