In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 19 | Yes |
Popular Name: 1-amino-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]cyclohexanecarboxamide 1-amino-N-[(4S)-4,5,6,7-tetrahyd…
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) | 1.89 | 4.86 | -50.67 | 4 | 3 | 1 | 57 | 279.429 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 4.58 | -6.7 | 3 | 3 | 0 | 55 | 278.421 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.