In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2005 | 15 | Yes |
Popular Name: 3-(4-methyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-8-yl)propanoic 3-(4-methyl-6,9-diazabicyclo[4.3…
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) | 1.64 | 6.86 | -54.48 | 0 | 4 | -1 | 57 | 203.221 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.3 | -48.89 | 1 | 4 | 0 | 59 | 204.229 | 3 | ↓ |