In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 23 | Yes |
Popular Name: 3-cyclopropyl-5-[(3R)-3-methylpiperazin-1-yl]-[1,2,4]triazolo[4,3-c]quinazoline 3-cyclopropyl-5-[(3R)-3-methylpi…
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) | 2.02 | 10.82 | -56.81 | 2 | 6 | 1 | 63 | 309.397 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 9.59 | -11.19 | 1 | 6 | 0 | 58 | 308.389 | 2 | ↓ |