In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2004 | 27 | Yes |
Popular Name: 3-[(7R)-5,7-bis(p-tolyl)-6,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propan-1-ol 3-[(7R)-5,7-bis(p-tolyl)-6,7-dih…
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) | 3.92 | 11.47 | -15.31 | 1 | 5 | 0 | 63 | 360.461 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 12.37 | -29.53 | 3 | 5 | 1 | 68 | 361.469 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 11.96 | -29.1 | 2 | 5 | 1 | 65 | 361.469 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.92 | 11.79 | -35.41 | 2 | 5 | 1 | 65 | 361.469 | 5 | ↓ |