In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2006 | 22 | No |
Popular Name: 1-[[(1,1-dioxothiolan-3-yl)-ethyl-amino]methyl]naphthalen-2-ol 1-[[(1,1-dioxothiolan-3-yl)-ethy…
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) | 2.74 | 4.76 | -53.86 | 2 | 4 | 1 | 59 | 320.434 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 2.71 | -14.08 | 1 | 4 | 0 | 58 | 319.426 | 4 | ↓ |