In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2008 | 26 | Yes |
Popular Name: 2-(diethylaminomethyl)spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclohexane]-4-one 2-(diethylaminomethyl)spiro[1,6-…
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) | 3.89 | 9.61 | -8.66 | 1 | 4 | 0 | 49 | 351.494 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 11.43 | -49.23 | 2 | 4 | 1 | 50 | 352.502 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 9.24 | -41.32 | 1 | 4 | 0 | 53 | 351.494 | 4 | ↓ |