In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2007 | 23 | Yes |
Popular Name: 4-ethylsulfanyl-9-tetralin-2-yl-7-thia-3,5-diazabicyclo[4.3.0]nona-2,4,8,10-tetraen-2-ol 4-ethylsulfanyl-9-tetralin-2-yl-…
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) | 5.50 | 9.47 | -16.16 | 1 | 3 | 0 | 46 | 342.489 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.96 | 8.24 | -48.04 | 0 | 3 | -1 | 49 | 341.481 | 3 | ↓ |