In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 21 | Yes |
Popular Name: (5S)-2-(3-chloro-4-fluoro-phenyl)-N-ethyl-5,6,7,8-tetrahydroquinazolin-5-amine (5S)-2-(3-chloro-4-fluoro-phenyl…
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) | 2.92 | 8.65 | -46.26 | 2 | 3 | 1 | 42 | 306.792 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 7.7 | -4.87 | 1 | 3 | 0 | 38 | 305.784 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.