In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2004 | 23 | No |
Popular Name: (9R)-6,6-dimethyl-9-(p-tolyl)-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one (9R)-6,6-dimethyl-9-(p-tolyl)-4,…
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) | 2.83 | 11.9 | -14.33 | 1 | 5 | 0 | 60 | 308.385 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 12.23 | -45.24 | 2 | 5 | 1 | 64 | 309.393 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.57 | 10.74 | -44.26 | 1 | 5 | -1 | 66 | 307.377 | 1 | ↓ |