In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2010 | 20 | Yes |
Popular Name: 6,7-dimethyl-5-(3-methylphenyl)-1,3-dihydro-2H-thieno[2,3-e][1,4]diazepin-2-one 6,7-dimethyl-5-(3-methylphenyl)-…
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) | 2.99 | 5.48 | -7.81 | 1 | 3 | 0 | 41 | 284.384 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 6.39 | -27.87 | 2 | 3 | 1 | 43 | 285.392 | 1 | ↓ |