In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 21 | Yes |
Popular Name: (2R)-2-amino-2-phenyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]propanamide (2R)-2-amino-2-phenyl-N-[(4R)-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) | 1.95 | 6.04 | -9.41 | 3 | 3 | 0 | 55 | 300.427 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 6.29 | -53.8 | 4 | 3 | 1 | 57 | 301.435 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.