In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 21 | Yes |
Popular Name: (2S)-7-chloro-3-propyl-2-(3-pyridyl)-1,2-dihydroquinazolin-4-one (2S)-7-chloro-3-propyl-2-(3-pyri…
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) | 2.44 | 7.69 | -10.08 | 1 | 4 | 0 | 45 | 301.777 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.44 | 8.15 | -43.95 | 2 | 4 | 1 | 46 | 302.785 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.