In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 24 | Yes |
Popular Name: 2-[(2-cyclopropylquinazolin-4-yl)thio]-1-(4-methylpiperidino)ethanone 2-[(2-cyclopropylquinazolin-4-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) | 3.21 | 10.47 | -11.2 | 0 | 4 | 0 | 46 | 341.48 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | 10.8 | -28.51 | 1 | 4 | 1 | 47 | 342.488 | 4 | ↓ |