In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | No |
Popular Name: [4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)thiadiazol-5-yl]hydrazine [4-(3,5-dihydro-2H-1,4-benzoxaze…
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) | 1.21 | 1.04 | -10.65 | 3 | 6 | 0 | 76 | 277.353 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 3.13 | -42.63 | 4 | 6 | 1 | 78 | 278.361 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.