In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 20 | Yes |
Popular Name: (5S)-2-(3-chloro-4-fluoro-phenyl)-N-methyl-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) | 2.54 | 7.82 | -47.72 | 2 | 3 | 1 | 42 | 292.765 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 6.75 | -5.07 | 1 | 3 | 0 | 38 | 291.757 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.