In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2010 | 22 | Yes |
Popular Name: 7-methyl-5-(2-methylphenyl)-6-propyl-1,3-dihydro-2H-thieno[2,3-e][1,4]diazepin-2-one 7-methyl-5-(2-methylphenyl)-6-pr…
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) | 3.82 | 6.07 | -7.29 | 1 | 3 | 0 | 41 | 312.438 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.82 | 7.03 | -27.72 | 2 | 3 | 1 | 43 | 313.446 | 3 | ↓ |