In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2004 | 27 | Yes |
Popular Name: 6,7-dimethyl-5-(o-tolyl)-1-(3-pyridylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one 6,7-dimethyl-5-(o-tolyl)-1-(3-py…
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 | 9.12 | -8.56 | 0 | 4 | 0 | 46 | 375.497 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.01 | 9.4 | -37.77 | 1 | 4 | 1 | 47 | 376.505 | 3 | ↓ |