In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: (3S)-3-[methyl(tetrahydropyran-4-yl)amino]-3-phenyl-propanamidine (3S)-3-[methyl(tetrahydropyran-4…
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) | 1.66 | 2.55 | -36.89 | 4 | 4 | 1 | 64 | 262.377 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 4.33 | -113.18 | 5 | 4 | 2 | 65 | 263.385 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.