In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 29 | Yes |
Popular Name: 2-[(1R)-1-(4-heptanoylpiperazin-1-yl)propyl]-3-methyl-quinazolin-4-one 2-[(1R)-1-(4-heptanoylpiperazin-…
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) | 4.19 | 10.34 | -15.86 | 0 | 6 | 0 | 58 | 398.551 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 12.27 | -55.41 | 1 | 6 | 1 | 60 | 399.559 | 8 | ↓ |