In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2R)-2-amino-N,4-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2R)-2-amino-N,4-dimethyl-N-[(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) | 0.49 | 3.53 | -55.07 | 4 | 6 | 1 | 94 | 309.415 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 0.43 | -59.95 | 2 | 6 | -1 | 95 | 307.399 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.49 | 3.23 | -16.8 | 3 | 6 | 0 | 92 | 308.407 | 5 | ↓ |