In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 21 | No |
Popular Name: (3S)-3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N'-hydroxy-3-phenyl-propanamidine (3S)-3-(6,7-dihydro-4H-thieno[3,…
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) | 2.48 | 5.39 | -6.09 | 3 | 4 | 0 | 62 | 301.415 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 7.21 | -41.46 | 4 | 4 | 1 | 63 | 302.423 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.