UCSF

ZINC06266086

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2006 17 No

CAS Number: 3569-10-6

Other Names:

Valerenic Acid

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 3.92 9.77 -47.43 0 2 -1 40 233.331 2

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )