In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 10th, 2007 | 20 | Yes |
Popular Name: 3-chloro-8-(2-pyridylsulfanylmethyl)-1,7-diazabicyclo[4.4.0]deca-2,4,6,8-tetraen-10-one 3-chloro-8-(2-pyridylsulfanylmet…
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) | 3.21 | -0.53 | -11.59 | 0 | 4 | 0 | 47 | 303.774 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | -0.39 | -39.46 | 1 | 4 | 1 | 48 | 304.782 | 3 | ↓ |