In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 27 | Yes |
Popular Name: 4-allyl-1-[(2-keto-2-piperidino-ethyl)thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one 4-allyl-1-[(2-keto-2-piperidino-…
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) | 2.70 | 1.48 | -12.69 | 0 | 7 | 0 | 72 | 383.477 | 5 | ↓ |