In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 21 | Yes |
Popular Name: [4-cyclopropyl-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)thiazol-5-yl]methanamine [4-cyclopropyl-2-(1,3,4,5-tetrah…
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) | 3.01 | 8.56 | -48 | 3 | 3 | 1 | 44 | 300.451 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 8.17 | -6.75 | 2 | 3 | 0 | 42 | 299.443 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.